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5-Phenyl-1,2,4-triazolidine-1,2,3,3-tetracarboxylic acid tetraethyl ester
SpectraBase Compound ID LEjWKeX5HP0
InChI InChI=1S/C20H27N3O8/c1-5-28-16(24)20(17(25)29-6-2)21-15(14-12-10-9-11-13-14)22(18(26)30-7-3)23(20)19(27)31-8-4/h9-13,15,21H,5-8H2,1-4H3
InChIKey SUSVZOWMJLSFKR-UHFFFAOYSA-N
Mol Weight 437.45 g/mol
Molecular Formula C20H27N3O8
Exact Mass 437.179815 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3iZPG40kSRg
Name 5-Phenyl-1,2,4-triazolidine-1,2,3,3-tetracarboxylic acid tetraethyl ester
CAS Registry Number 76292-91-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H27N3O8
InChI InChI=1S/C20H27N3O8/c1-5-28-16(24)20(17(25)29-6-2)21-15(14-12-10-9-11-13-14)22(18(26)30-7-3)23(20)19(27)31-8-4/h9-13,15,21H,5-8H2,1-4H3
InChIKey SUSVZOWMJLSFKR-UHFFFAOYSA-N
Molecular Weight 437.449 g/mol
SMILES N1C(N(N(C1(C(=O)OCC)C(=O)OCC)C(=O)OCC)C(=O)OCC)c1ccccc1
SPLASH splash10-03di-0390000000-cf92bd12fabb531b9014
Source of Spectrum F-45-4666-26
Synonyms Tetraethyl 5-phenyl-1,2,4-triazolidine-1,2,3,3-tetracarboxylate
Wiley ID 1383758