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2-Phenylcycloheptanone

View entire compound with spectra: 2 NMR, 2 FTIR, and 1 MS (GC)

2-Phenylcycloheptanone
SpectraBase Compound ID KmLSMb1UETE
InChI InChI=1S/C13H16O/c14-13-10-6-2-5-9-12(13)11-7-3-1-4-8-11/h1,3-4,7-8,12H,2,5-6,9-10H2
InChIKey PVHNKILPLXXDDZ-UHFFFAOYSA-N
Mol Weight 188.27 g/mol
Molecular Formula C13H16O
Exact Mass 188.120115 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FjuZIwqETlO
Name 2-Phenylcycloheptanone
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number P22222
CAS Registry Number 14996-78-2
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16O
InChI InChI=1S/C13H16O/c14-13-10-6-2-5-9-12(13)11-7-3-1-4-8-11/h1,3-4,7-8,12H,2,5-6,9-10H2
InChIKey PVHNKILPLXXDDZ-UHFFFAOYSA-N
Observed nucleus 1H
Purity 99%
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms 2-Phenylcycloheptan-1-one ST50405202
Wiley ID SIAL_1HNMR_012484