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3-Phenylcycloheptanone

View entire compound with spectra: 2 MS (GC)

3-Phenylcycloheptanone
SpectraBase Compound ID LYhIDYFROt0
InChI InChI=1S/C13H16O/c14-13-9-5-4-8-12(10-13)11-6-2-1-3-7-11/h1-3,6-7,12H,4-5,8-10H2
InChIKey JLDCLDZGNYDRKX-UHFFFAOYSA-N
Mol Weight 188.27 g/mol
Molecular Formula C13H16O
Exact Mass 188.120115 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7kJo8vFcrlD
Name 3-Phenylcycloheptanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16O
InChI InChI=1S/C13H16O/c14-13-9-5-4-8-12(10-13)11-6-2-1-3-7-11/h1-3,6-7,12H,4-5,8-10H2
InChIKey JLDCLDZGNYDRKX-UHFFFAOYSA-N
Literature Reference DOI 10.1039/c1cy00214g
Molecular Weight 188.270 g/mol
SMILES C1CCCC(CC1=O)c1ccccc1
SPLASH splash10-004l-9100000000-e68061396270b2bc5068
Source of Spectrum CST-1-1605/SM4-5ca
Synonyms 3-Phenyl-1-cycloheptanone 3-Phenylcycloheptan-1-one
Wiley ID 1754161