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rel-(3S,5S)-2-(Alloxycarbonyl)-1-benzyl-4-[1-(formyloxy)-1-methylethyl)]-3-pyrazolidinecarboxylic acid methyl ester
SpectraBase Compound ID 5JZ2jmxpRfb
InChI InChI=1S/C20H26N2O6/c1-5-11-27-19(25)22-17(18(24)26-4)16(20(2,3)28-14-23)13-21(22)12-15-9-7-6-8-10-15/h5-10,14,16-17H,1,11-13H2,2-4H3/t16-,17-/m0/s1
InChIKey JWJPIUKWFRDOPU-IRXDYDNUSA-N
Mol Weight 390.44 g/mol
Molecular Formula C20H26N2O6
Exact Mass 390.179087 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BTNRl9JBVh6
Name rel-(3S,5S)-2-(Alloxycarbonyl)-1-benzyl-4-[1-(formyloxy)-1-methylethyl)]-3-pyrazolidinecarboxylic acid methyl ester
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H26N2O6
InChI InChI=1S/C20H26N2O6/c1-5-11-27-19(25)22-17(18(24)26-4)16(20(2,3)28-14-23)13-21(22)12-15-9-7-6-8-10-15/h5-10,14,16-17H,1,11-13H2,2-4H3/t16-,17-/m0/s1
InChIKey JWJPIUKWFRDOPU-IRXDYDNUSA-N
Molecular Weight 390.436 g/mol
SMILES [C@]1(N(N(Cc2ccccc2)C[C@@]1(C(OC=O)(C)C)[H])C(=O)OCC=C)(C(=O)OC)[H]
SPLASH splash10-0006-9014000000-06ca9e51def3f7f3f0bc
Source of Spectrum F-49-8620-40
Synonyms 1-Allyl 5-methyl (4S,5S)-2-benzyl-4-[1-(formyloxy)-1-methylethyl]-1,5-pyrazolidinedicarboxylate
Wiley ID 788303