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Dimethyl-2-benzyl-c-5-(2-hydroxyphenyl)pyrrolidine-c-3,t-4-dicarboxylate-r-2-carboxylic acid
SpectraBase Compound ID DKde1YsFSY2
InChI InChI=1S/C22H23NO7/c1-29-19(25)16-17(20(26)30-2)22(21(27)28,12-13-8-4-3-5-9-13)23-18(16)14-10-6-7-11-15(14)24/h3-11,16-18,23-24H,12H2,1-2H3,(H,27,28)/t16-,17+,18+,22+/m0/s1
InChIKey AUVYTYVRXUVKFN-KCXPTXFHSA-N
Mol Weight 413.43 g/mol
Molecular Formula C22H23NO7
Exact Mass 413.147452 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FuRlOUm00xI
Name Dimethyl-2-benzyl-c-5-(2-hydroxyphenyl)pyrrolidine-c-3,t-4-dicarboxylate-r-2-carboxylic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H23NO7
InChI InChI=1S/C22H23NO7/c1-29-19(25)16-17(20(26)30-2)22(21(27)28,12-13-8-4-3-5-9-13)23-18(16)14-10-6-7-11-15(14)24/h3-11,16-18,23-24H,12H2,1-2H3,(H,27,28)/t16-,17+,18+,22+/m0/s1
InChIKey AUVYTYVRXUVKFN-KCXPTXFHSA-N
Molecular Weight 413.426 g/mol
SMILES N1[C@@](C(=O)O)([C@]([C@](C(=O)OC)([C@]1(c1c(O)cccc1)[H])[H])(C(=O)OC)[H])Cc1ccccc1
SPLASH splash10-0006-8097000000-c082b510d631a9fd17b0
Source of Spectrum F-50-3165-4
Synonyms (2R,3S,4S,5S)-2-benzyl-5-(2-hydroxyphenyl)-3,4-bis(methoxycarbonyl)-2-pyrrolidinecarboxylic acid
Wiley ID 1375009