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N-(3-dimethylaminopropyl)-1-(4-phenylbenzyl)-5-phenyl-1H-1,2,3-triazole-4-carboxamide
SpectraBase Compound ID 4BOUorDDLhi
InChI InChI=1S/C27H29N5O/c1-31(2)19-9-18-28-27(33)25-26(24-12-7-4-8-13-24)32(30-29-25)20-21-14-16-23(17-15-21)22-10-5-3-6-11-22/h3-8,10-17H,9,18-20H2,1-2H3,(H,28,33)
InChIKey XQYBHXDNVQNTJL-UHFFFAOYSA-N
Mol Weight 439.56 g/mol
Molecular Formula C27H29N5O
Exact Mass 439.237211 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LaRgEAhqmRs
Name N-(3-dimethylaminopropyl)-1-(4-phenylbenzyl)-5-phenyl-1H-1,2,3-triazole-4-carboxamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H29N5O
InChI InChI=1S/C27H29N5O/c1-31(2)19-9-18-28-27(33)25-26(24-12-7-4-8-13-24)32(30-29-25)20-21-14-16-23(17-15-21)22-10-5-3-6-11-22/h3-8,10-17H,9,18-20H2,1-2H3,(H,28,33)
InChIKey XQYBHXDNVQNTJL-UHFFFAOYSA-N
Literature Reference DOI 10.1002/ardp.200300837
Molecular Weight 439.563 g/mol
SMILES N(CCCN(C)C)C(=O)c1c([n](nn1)Cc1ccc(cc1)-c1ccccc1)-c1ccccc1
SPLASH splash10-0a4i-9300100000-3fb1603bd7d161f84996
Source of Spectrum APP-337-163-12e
Synonyms 1-([1,1'-biphenyl]-4-ylmethyl)-N-(3-(dimethylamino)propyl)-5-phenyl-1H-1,2,3-triazole-4-carboxamide N-[3-(dimethylamino)propyl]-5-phenyl-1-[(4-phenylphenyl)methyl]-4-triazolecarboxamide N-[3-(dimethylamino)propyl]-5-phenyl-1-[(4-phenylphenyl)methyl]triazole-4-carboxamide N-[3-(dimethylamino)propyl]-5-phenyl-1-[(4-phenylphenyl)methyl]-1,2,3-triazole-4-carboxamide
Wiley ID 1770797