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(3-Oxo-cyclohexyl)-carbamic acid benzyl ester
SpectraBase Compound ID IMqcDuGzS0C
InChI InChI=1S/C14H17NO3/c16-13-8-4-7-12(9-13)15-14(17)18-10-11-5-2-1-3-6-11/h1-3,5-6,12H,4,7-10H2,(H,15,17)
InChIKey NDTIOGCPRWWFJC-UHFFFAOYSA-N
Mol Weight 247.29 g/mol
Molecular Formula C14H17NO3
Exact Mass 247.120843 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 62tvAY2dVFk
Name (3-Oxo-cyclohexyl)-carbamic acid benzyl ester
Alternate Name(s) Benzyl (3-oxocyclohexyl)carbamate N-(3-oxocyclohexyl)carbamic acid (phenylmethyl) ester Benzyl N-(3-oxocyclohexyl)carbamate (phenylmethyl) N-(3-oxidanylidenecyclohexyl)carbamate
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Formula C14H17NO3
InChI InChI=1S/C14H17NO3/c16-13-8-4-7-12(9-13)15-14(17)18-10-11-5-2-1-3-6-11/h1-3,5-6,12H,4,7-10H2,(H,15,17)
InChIKey NDTIOGCPRWWFJC-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol702302y
Molecular Weight 247.294 g/mol
SMILES N(C(OCc1ccccc1)=O)C1CC(CCC1)=O
SPLASH splash10-0006-9320000000-8863740cafadf0cb120f
Source of Spectrum A1-9-5195/SMS6-3a'
Wiley ID 1758813