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Benzene, 2-heptenyl-

View entire compound with spectra: 3 MS (GC)

Benzene, 2-heptenyl-
SpectraBase Compound ID HJ0JAF1xjg6
InChI InChI=1S/C13H18/c1-2-3-4-5-7-10-13-11-8-6-9-12-13/h5-9,11-12H,2-4,10H2,1H3/b7-5+
InChIKey ZXOFDLMHPUQRCE-FNORWQNLSA-N
Mol Weight 174.29 g/mol
Molecular Formula C13H18
Exact Mass 174.140851 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9kSkMYrd1z8
Name Benzene, 2-heptenyl-
Alternate Name(s) (2E)-2-Heptenylbenzene 2-Heptene, 1-phenyl- 2-Heptenylbenzene [(E)-hept-2-enyl]benzene
CAS Registry Number 26447-63-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18
InChI InChI=1S/C13H18/c1-2-3-4-5-7-10-13-11-8-6-9-12-13/h5-9,11-12H,2-4,10H2,1H3/b7-5+
InChIKey ZXOFDLMHPUQRCE-FNORWQNLSA-N
Molecular Weight 174.287 g/mol
SMILES CCCC\C=C\Cc1ccccc1
SPLASH splash10-0gbc-5900000000-6e2c42b03ada1ee6d2e0
Source of Spectrum C-91-6809-2
Wiley ID 16770