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3-Methylcyclohexanone

View entire compound with spectra: 10 NMR, and 3 FTIR

3-Methylcyclohexanone
SpectraBase Compound ID CpuscPM4GzL
InChI InChI=1S/C7H12O/c1-6-3-2-4-7(8)5-6/h6H,2-5H2,1H3/t6-/m1/s1
InChIKey UJBOOUHRTQVGRU-ZCFIWIBFSA-N
Mol Weight 112.17 g/mol
Molecular Formula C7H12O
Exact Mass 112.088815 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HxPfWyzxHMt
Name (R)-(+)-3-Methylcyclohexanone
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number M38583
CAS Registry Number 13368-65-5
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H12O
InChI InChI=1S/C7H12O/c1-6-3-2-4-7(8)5-6/h6H,2-5H2,1H3/t6-/m1/s1
InChIKey UJBOOUHRTQVGRU-ZCFIWIBFSA-N
Observed nucleus 13C
Purity 98%
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms (3R)-3-Methylcyclohexanone (3R)-3-methylcyclohexan-1-one
Wiley ID SIAL_13CNMR_012284