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Methyl 1-amino-4-phenyl-2-oxocyclohexane-1-carboxylate
SpectraBase Compound ID 1rYnmZ3RNEM
InChI InChI=1S/C14H17NO3/c1-18-13(17)14(15)8-7-11(9-12(14)16)10-5-3-2-4-6-10/h2-6,11H,7-9,15H2,1H3/t11-,14+/m1/s1
InChIKey VKKRYDNEIURUAX-RISCZKNCSA-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 EFq2XjCPvx0
Name Methyl 1-amino-4-phenyl-2-oxocyclohexane-1-carboxylate
Alternate Name(s) (1S,4R)-Methyl 1-amino-2-oxo-4-phenyl-cyclohexane-1-carboxylate (1S,4R)-Methyl 1-amino-4-phenyl-2-oxocyclohexane-1-carboxylate Methyl 1-amino-2-oxo-4-phenyl-3-cyclohexane-1-carboxylate Methyl 1-amino-2-oxo-4-phenylcyclohexanecarboxylate
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Formula C14H17NO3
InChI InChI=1S/C14H17NO3/c1-18-13(17)14(15)8-7-11(9-12(14)16)10-5-3-2-4-6-10/h2-6,11H,7-9,15H2,1H3/t11-,14+/m1/s1
InChIKey VKKRYDNEIURUAX-RISCZKNCSA-N
Molecular Weight 247.294 g/mol
SMILES N[C@@]1(C(C[C@@](CC1)(c1ccccc1)[H])=O)C(=O)OC
SPLASH splash10-03di-0910000000-a6742fa5feeb27150147
Source of Spectrum SK-32-579-8
Wiley ID 1548568