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3-Phenyl-1,2-heptadiene

View entire compound with spectra: 1 MS (GC)

3-Phenyl-1,2-heptadiene
SpectraBase Compound ID CmgstYlWHGy
InChI InChI=1S/C13H16/c1-3-5-9-12(4-2)13-10-7-6-8-11-13/h6-8,10-11H,2-3,5,9H2,1H3
InChIKey HQZFSHGTEUJEJJ-UHFFFAOYSA-N
Mol Weight 172.27 g/mol
Molecular Formula C13H16
Exact Mass 172.125201 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ep8hR4CWckW
Name 3-Phenyl-1,2-heptadiene
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16
InChI InChI=1S/C13H16/c1-3-5-9-12(4-2)13-10-7-6-8-11-13/h6-8,10-11H,2-3,5,9H2,1H3
InChIKey HQZFSHGTEUJEJJ-UHFFFAOYSA-N
Molecular Weight 172.271 g/mol
SMILES C(=C=C)(c1ccccc1)CCCC
SPLASH splash10-001i-0900000000-3559cec9cca0cf037e1f
Source of Spectrum F-65-3698-2a
Synonyms 1-Vinylidenepentylbenzene hepta-1,2-dien-3-ylbenzene
Wiley ID 1680599