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Benzene, 5-heptenyl-

View entire compound with spectra: 1 NMR, 1 FTIR, and 2 MS (GC)

Benzene, 5-heptenyl-
SpectraBase Compound ID 9zzOk1eNH2F
InChI InChI=1S/C13H18/c1-2-3-4-5-7-10-13-11-8-6-9-12-13/h2-3,6,8-9,11-12H,4-5,7,10H2,1H3/b3-2+
InChIKey FIFNZEUTWPRNBN-NSCUHMNNSA-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 1C9ESizfijC
Name Benzene, 5-heptenyl-
CAS Registry Number 26447-66-5
Copyright Copyright © 2020-2025 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/h2-3,6,8-9,11-12H,4-5,7,10H2,1H3/b3-2+
InChIKey FIFNZEUTWPRNBN-NSCUHMNNSA-N
Molecular Weight 174.287 g/mol
SMILES C\C=C\CCCCc1ccccc1
SPLASH splash10-0f6x-9800000000-c88d972c77e16af8b140
Source of Spectrum C-91-6809-5
Synonyms 2-Heptene, 7-phenyl- 7-Phenyl-2-heptene [(E)-hept-5-enyl]benzene
Wiley ID 16767