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1-[(1S)-1-phenylethyl]pyridine-4,4-dicarboxylic acid dimethyl ester
SpectraBase Compound ID 99lipbRkKCN
InChI InChI=1S/C17H19NO4/c1-13(14-7-5-4-6-8-14)18-11-9-17(10-12-18,15(19)21-2)16(20)22-3/h4-13H,1-3H3/t13-/m0/s1
InChIKey GXAQIMYFGZXZSG-ZDUSSCGKSA-N
Mol Weight 301.34 g/mol
Molecular Formula C17H19NO4
Exact Mass 301.131408 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1htEMwgMSDP
Name 1-[(1S)-1-phenylethyl]pyridine-4,4-dicarboxylic acid dimethyl ester
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Formula C17H19NO4
InChI InChI=1S/C17H19NO4/c1-13(14-7-5-4-6-8-14)18-11-9-17(10-12-18,15(19)21-2)16(20)22-3/h4-13H,1-3H3/t13-/m0/s1
InChIKey GXAQIMYFGZXZSG-ZDUSSCGKSA-N
Molecular Weight 301.342 g/mol
SMILES C1(C=CN(C=C1)[C@](c1ccccc1)(C)[H])(C(=O)OC)C(=O)OC
SPLASH splash10-000b-7960000000-3c0e624f80d386a55c92
Source of Spectrum KC-61-595-2
Synonyms Dimethyl 1-[(1S)-1-phenylethyl]pyridine-4,4-dicarboxylate
Wiley ID 1627155