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4,4-Dimethyl-3-(4-methylphenyl)-5-(1-pyrrolidinyl)triazolidine-1,2-dicarboxylic acid dipropan-2-yl ester
SpectraBase Compound ID 7D7JdoIzZxU
InChI InChI=1S/C23H36N4O4/c1-16(2)30-21(28)25-20(24-14-8-9-15-24)23(6,7)26(19-12-10-18(5)11-13-19)27(25)22(29)31-17(3)4/h10-13,16-17,20H,8-9,14-15H2,1-7H3
InChIKey SAZXKIBXKXLHCY-UHFFFAOYSA-N
Mol Weight 432.6 g/mol
Molecular Formula C23H36N4O4
Exact Mass 432.273656 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B5DvYs9Kf3u
Name 4,4-Dimethyl-3-(4-methylphenyl)-5-(1-pyrrolidinyl)triazolidine-1,2-dicarboxylic acid dipropan-2-yl ester
CAS Registry Number 87474-54-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H36N4O4
InChI InChI=1S/C23H36N4O4/c1-16(2)30-21(28)25-20(24-14-8-9-15-24)23(6,7)26(19-12-10-18(5)11-13-19)27(25)22(29)31-17(3)4/h10-13,16-17,20H,8-9,14-15H2,1-7H3
InChIKey SAZXKIBXKXLHCY-UHFFFAOYSA-N
Molecular Weight 432.565 g/mol
SMILES c1(N2N(N(C(C2(C)C)N2CCCC2)C(OC(C)C)=O)C(OC(C)C)=O)ccc(cc1)C
SPLASH splash10-052o-8921000000-8f616b42a466fe339651
Source of Spectrum H-66-1616-0
Synonyms 4,4-Dimethyl-3-(p-tolyl)-5-pyrrolidino-triazolidine-1,2-dicarboxylic acid diisopropyl ester diisopropyl 4,4-dimethyl-3-(p-tolyl)-5-pyrrolidin-1-yl-triazolidine-1,2-dicarboxylate dipropan-2-yl 4,4-dimethyl-3-(4-methylphenyl)-5-pyrrolidin-1-yl-1,2,3-triazolidine-1,2-dicarboxylate dipropan-2-yl 4,4-dimethyl-3-(4-methylphenyl)-5-pyrrolidin-1-yltriazolidine-1,2-dicarboxylate
Wiley ID 1382250