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(1S,2S)-2-[(S)-nicotinamido(phenyl)methyl]cyclopropanecarboxylic acid methyl ester
SpectraBase Compound ID HrP10NWhZLC
InChI InChI=1S/C18H18N2O3/c1-23-18(22)15-10-14(15)16(12-6-3-2-4-7-12)20-17(21)13-8-5-9-19-11-13/h2-9,11,14-16H,10H2,1H3,(H,20,21)/t14-,15-,16+/m0/s1
InChIKey WXSSHHOBHSXBNE-HRCADAONSA-N
Mol Weight 310.35 g/mol
Molecular Formula C18H18N2O3
Exact Mass 310.131742 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1UzNvottIHm
Name (1S,2S)-2-[(S)-nicotinamido(phenyl)methyl]cyclopropanecarboxylic acid methyl ester
Alternate Name(s) (1S,2S)-2-[(S)-[[oxo(3-pyridinyl)methyl]amino]-phenylmethyl]-1-cyclopropanecarboxylic acid methyl ester Methyl (1S,2S)-2-[(S)-phenyl-(pyridin-3-ylcarbonylamino)methyl]cyclopropane-1-carboxylate Methyl (1S,2S)-2-[(S)-phenyl-(pyridine-3-carbonylamino)methyl]cyclopropane-1-carboxylate Methyl (1S,2S)-2-[(S)-phenyl-(pyridine-3-carbonylamino)methyl]cyclopropanecarboxylate
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Formula C18H18N2O3
InChI InChI=1S/C18H18N2O3/c1-23-18(22)15-10-14(15)16(12-6-3-2-4-7-12)20-17(21)13-8-5-9-19-11-13/h2-9,11,14-16H,10H2,1H3,(H,20,21)/t14-,15-,16+/m0/s1
InChIKey WXSSHHOBHSXBNE-HRCADAONSA-N
Molecular Weight 310.353 g/mol
SMILES N([C@@]([C@@]1([C@@](C(=O)OC)(C1)[H])[H])(c1ccccc1)[H])C(c1cnccc1)=O
SPLASH splash10-0kk9-5790000000-2c82b00e605a55f9ad84
Source of Spectrum KC-61-11498-6
Wiley ID 1631498