Standard Article

Mass Spectrometry and Gas-Phase Ion Chemistry of Dienes and Polyenes

Dienes and Polyenes (2000)

  1. Dietmar Kuck1,2,
  2. Michael Mormann3

Published Online: 15 DEC 2009

DOI: 10.1002/9780470682531.pat0222

Patai's Chemistry of Functional Groups

Patai's Chemistry of Functional Groups

How to Cite

Kuck, D. and Mormann, M. 2009. Mass Spectrometry and Gas-Phase Ion Chemistry of Dienes and Polyenes. Patai's Chemistry of Functional Groups. .

Author Information

  1. 1

    Universität Bielefeld, Fakultät für Chemie, Bielefeld, Germany

  2. 2

    Universität-Gesamthochschule Paderborn, Germany and Fachbereich Chemie und Chemietechnik, Paderborn, Germany

  3. 3

    Universität-Gesamthochschule Paderborn, Fachbereich Chemie und Chemietechnik, Paderborn, Germany

Publication History

  1. Published Online: 15 DEC 2009

Featured Compounds

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  1. 1 - 30
Compound 65
Drug synonym:Not Available
Molecular Weight:66.1011
Molecular Formula:C5H6
SMILES:C1C=CC=C1
InChI:1S/C5H6/c1-2-4-5-3-1/h1-4H,5H2
InChIKey:ZSWFCLXCOIISFI-UHFFFAOYSA-N
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Compound 67
Drug synonym:Not Available
Molecular Weight:68.117
Molecular Formula:C5H8
SMILES:CC(=C)C=C
InChI:1S/C5H8/c1-4-5(2)3/h4H,1-2H2,3H3
InChIKey:RRHGJUQNOFWUDK-UHFFFAOYSA-N
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Compound 35
Drug synonym:Not Available
Molecular Weight:106.165
Molecular Formula:C8H10
SMILES:CC(C)=C1C=CC=C1
InChI:1S/C8H10/c1-7(2)8-5-3-4-6-8/h3-6H,1-2H3
InChIKey:WXACXMWYHXOSIX-UHFFFAOYSA-N
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Compound 51
Drug synonym:Not Available
Molecular Weight:104.1491
Molecular Formula:C8H8
SMILES:C1=C/C=C\C=C/C=C\1
InChI:Not Available
InChIKey:Not Available
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Compound 34
Drug synonym:Not Available
Molecular Weight:80.1283
Molecular Formula:C6H9
SMILES:[CH2]C(=C)C([CH2-])=C
InChI:1S/C6H9/c1-5(2)6(3)4/h1-3H2,4H3/q-1
InChIKey:BOHJIMQLRHLZCQ-UHFFFAOYSA-N
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Compound 38
Drug synonym:Not Available
Molecular Weight:80.1277
Molecular Formula:C6H8
SMILES:C=C1CC(=C)C1
InChI:1S/C6H8/c1-5-3-6(2)4-5/h1-4H2
InChIKey:DTSPMBOMCCTXSG-UHFFFAOYSA-N
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Compound 40
Drug synonym:Not Available
Molecular Weight:200.4686
Molecular Formula:C10H24Si2
SMILES:C[Si](C)(C)CC(=C)C[Si](C)(C)C
InChI:1S/C10H24Si2/c1-10(8-11(2,3)4)9-12(5,6)7/h1,8-9H2,2-7H3
InChIKey:GAIZPGZRSSRFOZ-UHFFFAOYSA-N
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Compound 41
Drug synonym:Not Available
Molecular Weight:130.1864
Molecular Formula:C10H10
SMILES:[H][C@]12C=C[C@]3([H])C=C[C@]([H])(C=C1)[C@]23[H]
InChI:1S/C10H10/c1-2-8-5-6-9-4-3-7(1)10(8)9/h1-10H/t7-,8+,9-,10+
InChIKey:HKRMLKXSBBQRIM-YNFQOJQRSA-N
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Compound 44
Drug synonym:Not Available
Molecular Weight:Not Available
Molecular Formula:Not Available
SMILES:Not Available
InChI:Not Available
InChIKey:Not Available
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Compound 43
Drug synonym:Not Available
Molecular Weight:126.1546
Molecular Formula:C10H6
SMILES:c1cc2ccc3ccc1c23
InChI:1S/C10H6/c1-2-8-5-6-9-4-3-7(1)10(8)9/h1-6H
InChIKey:CUIAUPQXSDOJAG-UHFFFAOYSA-N
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Compound 45
Drug synonym:Not Available
Molecular Weight:92.1384
Molecular Formula:C7H8
SMILES:C1C=CC=CC=C1
InChI:1S/C7H8/c1-2-4-6-7-5-3-1/h1-6H,7H2
InChIKey:CHVJITGCYZJHLR-UHFFFAOYSA-N
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Compound 46
Drug synonym:Not Available
Molecular Weight:92.1384
Molecular Formula:C7H8
SMILES:CC1=CC=CC=C1
InChI:1S/C7H8/c1-7-5-3-2-4-6-7/h2-6H,1H3
InChIKey:YXFVVABEGXRONW-UHFFFAOYSA-N
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Compound 47
Drug synonym:Not Available
Molecular Weight:106.165
Molecular Formula:C8H10
SMILES:C1C2CC=CC1C=C2
InChI:1S/C8H10/c1-2-7-4-5-8(3-1)6-7/h1-2,4-5,7-8H,3,6H2
InChIKey:VTYQQMGYHHVPMX-UHFFFAOYSA-N
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Compound 48
Drug synonym:Not Available
Molecular Weight:106.165
Molecular Formula:C8H10
SMILES:C1C2CC=CC1C=C2
InChI:1S/C8H10/c1-2-7-4-5-8(3-1)6-7/h1-2,4-5,7-8H,3,6H2
InChIKey:VTYQQMGYHHVPMX-UHFFFAOYSA-N
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Compound 50
Drug synonym:Not Available
Molecular Weight:106.165
Molecular Formula:C8H10
SMILES:C=C1CC2CC1C=C2
InChI:1S/C8H10/c1-6-4-7-2-3-8(6)5-7/h2-3,7-8H,1,4-5H2
InChIKey:WTQBISBWKRKLIJ-UHFFFAOYSA-N
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Compound 49
Drug synonym:Not Available
Molecular Weight:108.1809
Molecular Formula:C8H12
SMILES:C1CC2CC1CC=C2
InChI:1S/C8H12/c1-2-7-4-5-8(3-1)6-7/h1-2,7-8H,3-6H2
InChIKey:YEHSTKKZWWSIMD-UHFFFAOYSA-N
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Compound 63
Drug synonym:Not Available
Molecular Weight:92.1384
Molecular Formula:C7H8
SMILES:C1C2C=CC1C=C2
InChI:1S/C7H8/c1-2-7-4-3-6(1)5-7/h1-4,6-7H,5H2
InChIKey:SJYNFBVQFBRSIB-UHFFFAOYSA-N
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Compound 54
Drug synonym:Not Available
Molecular Weight:104.1491
Molecular Formula:C8H8
SMILES:C1=C/C=C\C=C/C=C\1
InChI:Not Available
InChIKey:Not Available
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Compound 68
Drug synonym:Not Available
Molecular Weight:127.2036
Molecular Formula:C8H15O
SMILES:CC.CC1=[O+]CC=CC1
InChI:1S/C6H9O.C2H6/c1-6-4-2-3-5-7-6;1-2/h2-3H,4-5H2,1H3;1-2H3/q+1;
InChIKey:QMEDOKJHSACGJV-UHFFFAOYSA-N
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Compound 69
Drug synonym:Not Available
Molecular Weight:109.1452
Molecular Formula:C7H9O
SMILES:CC1=[O+]C2CC1C=C2
InChI:1S/C7H9O/c1-5-6-2-3-7(4-6)8-5/h2-3,6-7H,4H2,1H3/q+1
InChIKey:NOPBUUBRNDDTSK-UHFFFAOYSA-N
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Compound 73
Drug synonym:Not Available
Molecular Weight:85.1238
Molecular Formula:C5H9O
SMILES:C\[O+]=C(\C)C=C
InChI:1S/C5H9O/c1-4-5(2)6-3/h4H,1H2,2-3H3/q+1
InChIKey:XYBYVLPPSKOHGZ-UHFFFAOYSA-N
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Compound 74
Drug synonym:ethoxyethene
Molecular Weight:72.1057
Molecular Formula:C4H8O
SMILES:CCOC=C
InChI:1S/C4H8O/c1-3-5-4-2/h3H,1,4H2,2H3
InChIKey:FJKIXWOMBXYWOQ-UHFFFAOYSA-N
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Compound 75
Drug synonym:Not Available
Molecular Weight:171.2561
Molecular Formula:C10H19O2
SMILES:CCOC.C[O+]1C=CCC=C1C
InChI:1S/C7H11O.C3H8O/c1-7-5-3-4-6-8(7)2;1-3-4-2/h4-6H,3H2,1-2H3;3H2,1-2H3/q+1;
InChIKey:ZDVUENRURRHLIS-UHFFFAOYSA-N
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Compound 70
Drug synonym:Not Available
Molecular Weight:105.114
Molecular Formula:C7H5O
SMILES:[O+]#CC1=CC=CC=C1
InChI:1S/C7H5O/c8-6-7-4-2-1-3-5-7/h1-5H/q+1
InChIKey:UIVYRGNJIZIXRC-UHFFFAOYSA-N
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Compound 72
Drug synonym:Not Available
Molecular Weight:139.2143
Molecular Formula:C9H15O
SMILES:CC.[O+]#CC1CCC=CC1
InChI:1S/C7H9O.C2H6/c8-6-7-4-2-1-3-5-7;1-2/h1-2,7H,3-5H2;1-2H3/q+1;
InChIKey:RMWBUKWQNMZOPE-UHFFFAOYSA-N
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Compound 76
Drug synonym:Not Available
Molecular Weight:110.1968
Molecular Formula:C8H14
SMILES:C=CCCCCC=C
InChI:1S/C8H14/c1-3-5-7-8-6-4-2/h3-4H,1-2,5-8H2
InChIKey:XWJBRBSPAODJER-UHFFFAOYSA-N
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Compound 77
Drug synonym:Not Available
Molecular Weight:110.1968
Molecular Formula:C8H14
SMILES:C\C=C\CC\C=C\C
InChI:1S/C8H14/c1-3-5-7-8-6-4-2/h3-6H,7-8H2,1-2H3/b5-3+,6-4+
InChIKey:LAGGTOBQMQHXON-GGWOSOGESA-N
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Compound 78
Drug synonym:Not Available
Molecular Weight:110.1968
Molecular Formula:C8H14
SMILES:CCC\C=C\CC=C
InChI:1S/C8H14/c1-3-5-7-8-6-4-2/h3,7-8H,1,4-6H2,2H3/b8-7+
InChIKey:HYBLFDUGSBOMPI-BQYQJAHWSA-N
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Compound 79
Drug synonym:Not Available
Molecular Weight:292.4562
Molecular Formula:C19H32O2
SMILES:CC\C=C\C\C=C\C\C=C\CCCCCCCC(=O)OC
InChI:1S/C19H32O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(20)21-2/h4-5,7-8,10-11H,3,6,9,12-18H2,1-2H3/b5-4+,8-7+,11-10+
InChIKey:DVWSXZIHSUZZKJ-JSIPCRQOSA-N
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Compound 82
Drug synonym:Not Available
Molecular Weight:Not Available
Molecular Formula:Not Available
SMILES:Not Available
InChI:Not Available
InChIKey:Not Available
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