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Benzene, 3-heptenyl-
SpectraBase Compound ID DyARuwH09s4
InChI InChI=1S/C13H18/c1-2-3-4-5-7-10-13-11-8-6-9-12-13/h4-6,8-9,11-12H,2-3,7,10H2,1H3/b5-4+
InChIKey FINRYNINFIUTFW-SNAWJCMRSA-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 72DnGY1Z4Lt
Name Benzene, 3-heptenyl-
Alternate Name(s) (3E)-3-Heptenylbenzene 3-Heptene, 1-phenyl- [(E)-hept-3-enyl]benzene
CAS Registry Number 26447-64-3
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/h4-6,8-9,11-12H,2-3,7,10H2,1H3/b5-4+
InChIKey FINRYNINFIUTFW-SNAWJCMRSA-N
Molecular Weight 174.287 g/mol
SMILES CCC\C=C\CCc1ccccc1
SPLASH splash10-0006-9200000000-f081ebd9503fee7959fa
Source of Spectrum C-91-6809-3
Wiley ID 1171116