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1-(4,6-dipyrrolidino-s-triazin-2-yl)-5-phenyl-triazole-4-carboxylic acid ethyl ester
SpectraBase Compound ID 1tzw29YgDYN
InChI InChI=1S/C22H26N8O2/c1-2-32-19(31)17-18(16-10-4-3-5-11-16)30(27-26-17)22-24-20(28-12-6-7-13-28)23-21(25-22)29-14-8-9-15-29/h3-5,10-11H,2,6-9,12-15H2,1H3
InChIKey FPRKIACDHJINIB-UHFFFAOYSA-N
Mol Weight 434.5 g/mol
Molecular Formula C22H26N8O2
Exact Mass 434.217872 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HUcUT8cduAh
Name 1-(4,6-dipyrrolidino-s-triazin-2-yl)-5-phenyl-triazole-4-carboxylic acid ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H26N8O2
InChI InChI=1S/C22H26N8O2/c1-2-32-19(31)17-18(16-10-4-3-5-11-16)30(27-26-17)22-24-20(28-12-6-7-13-28)23-21(25-22)29-14-8-9-15-29/h3-5,10-11H,2,6-9,12-15H2,1H3
InChIKey FPRKIACDHJINIB-UHFFFAOYSA-N
Molecular Weight 434.504 g/mol
SMILES c1ccc(-c2c(C(=O)OCC)nn[n]2-c2nc(N3CCCC3)nc(n2)N2CCCC2)cc1
SPLASH splash10-0ac0-9412000000-526488fa90401dc60f32
Synonyms 1-[4,6-bis(1-pyrrolidinyl)-1,3,5-triazin-2-yl]-5-phenyl-4-triazolecarboxylic acid ethyl ester Ethyl 1-(4,6-dipyrrolidin-1-yl-1,3,5-triazin-2-yl)-5-phenyl-1,2,3-triazole-4-carboxylate Ethyl 1-(4,6-dipyrrolidin-1-yl-1,3,5-triazin-2-yl)-5-phenyl-triazole-4-carboxylate
Wiley ID 1445624