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(1S,6R)-3,4-dimethyl-6-(phenylmethoxycarbonylamino)-1-cyclohex-3-enecarboxylic acid methyl ester
SpectraBase Compound ID AsgElbnmyBZ
InChI InChI=1S/C18H23NO4/c1-12-9-15(17(20)22-3)16(10-13(12)2)19-18(21)23-11-14-7-5-4-6-8-14/h4-8,15-16H,9-11H2,1-3H3,(H,19,21)/t15-,16+/m0/s1
InChIKey OMSYOPQKUNKHGH-JKSUJKDBSA-N
Mol Weight 317.38 g/mol
Molecular Formula C18H23NO4
Exact Mass 317.162708 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4AFSJiWtsI7
Name (1S,6R)-3,4-dimethyl-6-(phenylmethoxycarbonylamino)-1-cyclohex-3-enecarboxylic acid methyl ester
Alternate Name(s) Methyl (1S,6R)-3,4-dimethyl-6-(phenylmethoxycarbonylamino)cyclohex-3-ene-1-carboxylate Methyl (1S,6R)-6-(benzyloxycarbonylamino)-3,4-dimethyl-cyclohex-3-ene-1-carboxylate
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Formula C18H23NO4
InChI InChI=1S/C18H23NO4/c1-12-9-15(17(20)22-3)16(10-13(12)2)19-18(21)23-11-14-7-5-4-6-8-14/h4-8,15-16H,9-11H2,1-3H3,(H,19,21)/t15-,16+/m0/s1
InChIKey OMSYOPQKUNKHGH-JKSUJKDBSA-N
Molecular Weight 317.385 g/mol
SMILES N(C(=O)OCc1ccccc1)[C@]1([C@](CC(=C(C)C1)C)(C(=O)OC)[H])[H]
SPLASH splash10-066r-0900000000-b0916a587bead1bb5968
Source of Spectrum SO-0-1725-5
Wiley ID 878571