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(2S)-2-Methyl-1-phenylheptan-3-one

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

(2S)-2-Methyl-1-phenylheptan-3-one
SpectraBase Compound ID 5ULYCb3lNrS
InChI InChI=1S/C14H20O/c1-3-4-10-14(15)12(2)11-13-8-6-5-7-9-13/h5-9,12H,3-4,10-11H2,1-2H3/t12-/m0/s1
InChIKey YPJPZJXXBCPBIV-LBPRGKRZSA-N
Mol Weight 204.31 g/mol
Molecular Formula C14H20O
Exact Mass 204.151415 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6zyM6hjbhrV
Name (2S)-2-Methyl-1-phenylheptan-3-one
Alternate Name(s) (2S)-2-methyl-1-phenyl-3-heptanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H20O
InChI InChI=1S/C14H20O/c1-3-4-10-14(15)12(2)11-13-8-6-5-7-9-13/h5-9,12H,3-4,10-11H2,1-2H3/t12-/m0/s1
InChIKey YPJPZJXXBCPBIV-LBPRGKRZSA-N
Molecular Weight 204.313 g/mol
SMILES C([C@@](C(CCCC)=O)(C)[H])c1ccccc1
SPLASH splash10-052o-9210000000-7e6fac50261b81bc079a
Source of Spectrum F-69-796-11
Wiley ID 1594562