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N-[2-(1-Benzyl-1H-1,2,3-triazol-4-yl)propan-2-yl]-3,5-dimethyl-[1,1'-biphenyl]-4-carboxamide
SpectraBase Compound ID JIy13egZOfq
InChI InChI=1S/C27H28N4O/c1-19-15-23(22-13-9-6-10-14-22)16-20(2)25(19)26(32)28-27(3,4)24-18-31(30-29-24)17-21-11-7-5-8-12-21/h5-16,18H,17H2,1-4H3,(H,28,32)
InChIKey CNISHJUQBGXVFH-UHFFFAOYSA-N
Mol Weight 424.55 g/mol
Molecular Formula C27H28N4O
Exact Mass 424.226312 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Hy3W5D1fj0E
Name N-[2-(1-Benzyl-1H-1,2,3-triazol-4-yl)propan-2-yl]-3,5-dimethyl-[1,1'-biphenyl]-4-carboxamide
Appearance Colorless solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 424.226311537 u
Formula C27H28N4O
InChI InChI=1S/C27H28N4O/c1-19-15-23(22-13-9-6-10-14-22)16-20(2)25(19)26(32)28-27(3,4)24-18-31(30-29-24)17-21-11-7-5-8-12-21/h5-16,18H,17H2,1-4H3,(H,28,32)
InChIKey CNISHJUQBGXVFH-UHFFFAOYSA-N
Instrument Name Finnigan MAT 95
Ionization Type EI
Literature Reference DOI 10.1002/chem.201501134
Molecular Weight 424.548 g/mol
Quality 84
Reported Formula C27H28N4O
SMILES N(C(C=1C(=CC(=CC1C)C1=CC=CC=C1)C)=O)C(C1=CN(N=N1)CC1=CC=CC=C1)(C)C
SPLASH splash10-052f-9271200000-baf0e9bd85164a8128fd
Source of Spectrum QE-21-SM8-2j (DOI: 10.1002/chem.201501134)
Wiley ID 1906633