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BENZYL-(1R,2S)-N-(2-HYDROXYCYCLOHEXYL)-CARBAMATE
SpectraBase Compound ID 6BsV0PUveoO
InChI InChI=1S/C14H19NO3/c16-13-9-5-4-8-12(13)15-14(17)18-10-11-6-2-1-3-7-11/h1-3,6-7,12-13,16H,4-5,8-10H2,(H,15,17)/t12-,13+/m1/s1
InChIKey IDQLGJJPYSFXPM-OLZOCXBDSA-N
Mol Weight 249.31 g/mol
Molecular Formula C14H19NO3
Exact Mass 249.136493 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8DJECravVjX
Name benzyl 2-hydroxycyclohexylcarbamate
Alternate Name(s) N-[(1R,2S)-2-hydroxycyclohexyl]carbamic acid (phenylmethyl) ester benzyl N-[(1R,2S)-2-hydroxycyclohexyl]carbamate (phenylmethyl) N-[(1R,2S)-2-oxidanylcyclohexyl]carbamate
Comments Less than 3 mono-isotopic peaks
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Formula C14H19NO3
InChI InChI=1S/C14H19NO3/c16-13-9-5-4-8-12(13)15-14(17)18-10-11-6-2-1-3-7-11/h1-3,6-7,12-13,16H,4-5,8-10H2,(H,15,17)/t12-,13+/m1/s1
InChIKey IDQLGJJPYSFXPM-OLZOCXBDSA-N
Molecular Weight 249.310 g/mol
SMILES N(C(=O)OCc1ccccc1)[C@]1([C@](CCCC1)(O)[H])[H]
SPLASH splash10-0006-9000000000-9eddcbb375cf2746ba8a
Source of Spectrum QC-9-4486-3
Wiley ID 870933