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2,3,4-Pyrrolidinetricarboxylic acid, 2-methyl-5-phenyl-, trimethyl ester, (2.alpha.,3.beta.,4.alpha.,5.alpha.)-(.+-.)-
SpectraBase Compound ID 8nutwsTbJqd
InChI InChI=1S/C17H21NO6/c1-17(16(21)24-4)12(15(20)23-3)11(14(19)22-2)13(18-17)10-8-6-5-7-9-10/h5-9,11-13,18H,1-4H3/t11-,12+,13-,17-/m0/s1
InChIKey CLCONKAZEYBTDE-LKQDWFRTSA-N
Mol Weight 335.36 g/mol
Molecular Formula C17H21NO6
Exact Mass 335.136887 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6UcH0XnNWmN
Name 2,3,4-Pyrrolidinetricarboxylic acid, 2-methyl-5-phenyl-, trimethyl ester, (2.alpha.,3.beta.,4.alpha.,5.alpha.)-(.+-.)-
CAS Registry Number 113349-51-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H21NO6
InChI InChI=1S/C17H21NO6/c1-17(16(21)24-4)12(15(20)23-3)11(14(19)22-2)13(18-17)10-8-6-5-7-9-10/h5-9,11-13,18H,1-4H3/t11-,12+,13-,17-/m0/s1
InChIKey CLCONKAZEYBTDE-LKQDWFRTSA-N
Molecular Weight 335.356 g/mol
SMILES N1[C@]([C@]([C@@]([C@]1(C(=O)OC)C)(C(=O)OC)[H])(C(=O)OC)[H])(c1ccccc1)[H]
SPLASH splash10-00pl-0890000000-1c9690372a33a70eb4b5
Source of Spectrum J-53-1389-3
Synonyms 2-Methyl-trans-2,3,4-trimethoxycarbonyl-5-phenyl-2,3,4,5-tetrahydro-pyrrole Trimethyl (2S,3S,4S,5R)-2-methyl-5-phenyl-2,3,4-pyrrolidinetricarboxylate
Wiley ID 1331629