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1H-Furo[3,4-c]pyrrole-4-carboxylic acid, hexahydro-1,3-dioxo-6-phenyl-4-(phenylmethyl)-, methyl ester, (3a.alpha.,4.beta.,6.beta.,6a.alpha.)-(.+-.)-
SpectraBase Compound ID 4TuLS82F4c2
InChI InChI=1S/C21H19NO5/c1-26-20(25)21(12-13-8-4-2-5-9-13)16-15(18(23)27-19(16)24)17(22-21)14-10-6-3-7-11-14/h2-11,15-17,22H,12H2,1H3/t15-,16-,17-,21-/m1/s1
InChIKey CXWVPNZSSLIYBA-BZLDKRAPSA-N
Mol Weight 365.39 g/mol
Molecular Formula C21H19NO5
Exact Mass 365.126323 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HrjfJIou6yf
Name 1H-Furo[3,4-c]pyrrole-4-carboxylic acid, hexahydro-1,3-dioxo-6-phenyl-4-(phenylmethyl)-, methyl ester, (3a.alpha.,4.beta.,6.beta.,6a.alpha.)-(.+-.)-
CAS Registry Number 113430-18-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H19NO5
InChI InChI=1S/C21H19NO5/c1-26-20(25)21(12-13-8-4-2-5-9-13)16-15(18(23)27-19(16)24)17(22-21)14-10-6-3-7-11-14/h2-11,15-17,22H,12H2,1H3/t15-,16-,17-,21-/m1/s1
InChIKey CXWVPNZSSLIYBA-BZLDKRAPSA-N
Molecular Weight 365.385 g/mol
SMILES N1[C@@]([C@]2([C@@]([C@@]1(C(=O)OC)Cc1ccccc1)(C(OC2=O)=O)[H])[H])(c1ccccc1)[H]
SPLASH splash10-00di-0090000000-b584285b63c0a394d2a4
Source of Spectrum KC-1987-2293-16
Synonyms Methyl (3aS,4R,6S,6aR)-4-benzyl-1,3-dioxo-6-phenylhexahydro-1H-furo[3,4-c]pyrrole-4-carboxylate Methyl 2-benzyl-6,8-dioxo-4-phenyl-7-oxa-3-azacyclo[3.3.0]octane-2-carboxylate
Wiley ID 1351429