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(1E)-1-Heptenylbenzene
SpectraBase Compound ID JGLjSJB26FN
InChI InChI=1S/C13H18/c1-2-3-4-5-7-10-13-11-8-6-9-12-13/h6-12H,2-5H2,1H3/b10-7+
InChIKey PNLSTDKQAPNMDU-JXMROGBWSA-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 JpSviCPu0CC
Name (1E)-1-Heptenylbenzene
CAS Registry Number 829-99-2
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/h6-12H,2-5H2,1H3/b10-7+
InChIKey PNLSTDKQAPNMDU-JXMROGBWSA-N
Molecular Weight 174.287 g/mol
SMILES C(\C=C\c1ccccc1)CCCC
SPLASH splash10-00xr-0900000000-25f0f47b2f6443979d9f
Source of Spectrum C5-2005-156-25
Synonyms 1-Heptene, 1-phenyl- Benzene, 1-heptenyl- 1-Heptenylbenzene [(E)-hept-1-enyl]benzene
Wiley ID 1617890