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(E)-1-Phenyl-1-octen-3-one
SpectraBase Compound ID GwQQte0g5go
InChI InChI=1S/C14H18O/c1-2-3-5-10-14(15)12-11-13-8-6-4-7-9-13/h4,6-9,11-12H,2-3,5,10H2,1H3/b12-11+
InChIKey WDAQVRGVKLLSHT-VAWYXSNFSA-N
Mol Weight 202.3 g/mol
Molecular Formula C14H18O
Exact Mass 202.135765 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2GPdpvRclqO
Name (E)-1-Phenyl-1-octen-3-one
Alternate Name(s) (E)-1-Phenyloct-1-en-3-one (1E)-1-phenyl-1-octen-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18O
InChI InChI=1S/C14H18O/c1-2-3-5-10-14(15)12-11-13-8-6-4-7-9-13/h4,6-9,11-12H,2-3,5,10H2,1H3/b12-11+
InChIKey WDAQVRGVKLLSHT-VAWYXSNFSA-N
Literature Reference DOI 10.1016/j.bmc.2013.01.055
Molecular Weight 202.297 g/mol
SMILES c1(ccccc1)\C=C\C(CCCCC)=O
SPLASH splash10-001i-0900000000-db9a5b8daebce5e45a19
Source of Spectrum G2-21-1712-1a
Wiley ID 1754105