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2-Phenylheptan-3-one
SpectraBase Compound ID LZydUuhcBJZ
InChI InChI=1S/C13H18O/c1-3-4-10-13(14)11(2)12-8-6-5-7-9-12/h5-9,11H,3-4,10H2,1-2H3
InChIKey ONPYCUBGRGFJSW-UHFFFAOYSA-N
Mol Weight 190.29 g/mol
Molecular Formula C13H18O
Exact Mass 190.135765 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IQmB562GRKz
Name 2-Phenylheptan-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18O
InChI InChI=1S/C13H18O/c1-3-4-10-13(14)11(2)12-8-6-5-7-9-12/h5-9,11H,3-4,10H2,1-2H3
InChIKey ONPYCUBGRGFJSW-UHFFFAOYSA-N
Molecular Weight 190.286 g/mol
SMILES C(C(c1ccccc1)C)(=O)CCCC
SPLASH splash10-052r-6900000000-9a5981ef22dd6abf875a
Source of Spectrum B-47-1673-0
Synonyms 2-Phenyl-3-heptanone
Wiley ID 1187067