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1-Phenyl-5-hexen-1-one
SpectraBase Compound ID 5jajqXeOdNW
InChI InChI=1S/C12H14O/c1-2-3-5-10-12(13)11-8-6-4-7-9-11/h2,4,6-9H,1,3,5,10H2
InChIKey FNMHKQVEFZLMQD-UHFFFAOYSA-N
Mol Weight 174.24 g/mol
Molecular Formula C12H14O
Exact Mass 174.104465 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2I2HrtwP0Jf
Name 1-Phenylhex-5-en-1-one
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 174.104465070 u
Formula C12H14O
InChI InChI=1S/C12H14O/c1-2-3-5-10-12(13)11-8-6-4-7-9-11/h2,4,6-9H,1,3,5,10H2
InChIKey FNMHKQVEFZLMQD-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/anie.202116625
Molecular Weight 174.243 g/mol
Quality 222
Reported Formula C12H14O
SMILES C1(C(CCCC=C)=O)=CC=CC=C1
SPLASH splash10-0ab9-2900000000-644163dfb2dc4eb21ea6
Source of Spectrum ACI-61-SM20-3f (DOI: 10.1002/anie.202116625)
Wiley ID 1897514