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N-[2-(2-hydroxyethylamino)-ethyl]-1-heptyl-5-phenyl-1H-1,2,3-triazole-4-carboxamide
SpectraBase Compound ID 5fXbwVuZqaC
InChI InChI=1S/C20H31N5O2/c1-2-3-4-5-9-15-25-19(17-10-7-6-8-11-17)18(23-24-25)20(27)22-13-12-21-14-16-26/h6-8,10-11,21,26H,2-5,9,12-16H2,1H3,(H,22,27)
InChIKey KOYJYMPCBYYVLQ-UHFFFAOYSA-N
Mol Weight 373.5 g/mol
Molecular Formula C20H31N5O2
Exact Mass 373.247775 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GSpyR5YSvHY
Name N-[2-(2-hydroxyethylamino)-ethyl]-1-heptyl-5-phenyl-1H-1,2,3-triazole-4-carboxamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H31N5O2
InChI InChI=1S/C20H31N5O2/c1-2-3-4-5-9-15-25-19(17-10-7-6-8-11-17)18(23-24-25)20(27)22-13-12-21-14-16-26/h6-8,10-11,21,26H,2-5,9,12-16H2,1H3,(H,22,27)
InChIKey KOYJYMPCBYYVLQ-UHFFFAOYSA-N
Literature Reference DOI 10.1002/ardp.200300837
Molecular Weight 373.501 g/mol
SMILES N(C(=O)c1nn[n](c1-c1ccccc1)CCCCCCC)CCNCCO
SPLASH splash10-0079-9466000000-c8e170967b748c92cb55
Source of Spectrum APP-337-163-12c
Synonyms 1-Heptyl-N-(2-((2-hydroxyethyl)amino)ethyl)-5-phenyl-1H-1,2,3-triazole-4-carboxamide 1-Heptyl-N-[2-(2-hydroxyethylamino)ethyl]-5-phenyl-4-triazolecarboxamide 1-Heptyl-N-[2-(2-hydroxyethylamino)ethyl]-5-phenyltriazole-4-carboxamide 1-Heptyl-N-[2-(2-hydroxyethylamino)ethyl]-5-phenyl-1,2,3-triazole-4-carboxamide
Wiley ID 1770796