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(1S,2S,6R)-6-(Benzyloxycarbonylamino)-2-methylcyclohex-3-ene-1-carboxylic acid methyl ester
SpectraBase Compound ID 9j21Iud5loe
InChI InChI=1S/C17H21NO4/c1-12-7-6-10-14(15(12)16(19)21-2)18-17(20)22-11-13-8-4-3-5-9-13/h3-9,12,14-15H,10-11H2,1-2H3,(H,18,20)/t12-,14+,15-/m0/s1
InChIKey LJQCJHRQVNYOLU-CFVMTHIKSA-N
Mol Weight 303.36 g/mol
Molecular Formula C17H21NO4
Exact Mass 303.147058 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LKb6gGEpKsJ
Name (1S,2S,6R)-6-(Benzyloxycarbonylamino)-2-methylcyclohex-3-ene-1-carboxylic acid methyl ester
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Formula C17H21NO4
InChI InChI=1S/C17H21NO4/c1-12-7-6-10-14(15(12)16(19)21-2)18-17(20)22-11-13-8-4-3-5-9-13/h3-9,12,14-15H,10-11H2,1-2H3,(H,18,20)/t12-,14+,15-/m0/s1
InChIKey LJQCJHRQVNYOLU-CFVMTHIKSA-N
Molecular Weight 303.358 g/mol
SMILES N(C(=O)OCc1ccccc1)[C@]1([C@@](C(=O)OC)([C@](C=CC1)(C)[H])[H])[H]
SPLASH splash10-002f-5900000000-eef405ed662d5e03a597
Source of Spectrum SO-0-1728-26
Synonyms Methyl (1S,2S,6R)-6-{[(benzyloxy)carbonyl]amino}-2-methyl-3-cyclohexene-1-carboxylate
Wiley ID 878556