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N-(2-(1-Benzyl-1H-1,2,3-triazol-4-yl)propan-2-yl)-4,5-dimethoxy-[1,1'-biphenyl]-2-carboxamide
SpectraBase Compound ID DDQVTiDSaUL
InChI InChI=1S/C27H28N4O3/c1-27(2,25-18-31(30-29-25)17-19-11-7-5-8-12-19)28-26(32)22-16-24(34-4)23(33-3)15-21(22)20-13-9-6-10-14-20/h5-16,18H,17H2,1-4H3,(H,28,32)
InChIKey OFJGLFBBILPTSK-UHFFFAOYSA-N
Mol Weight 456.55 g/mol
Molecular Formula C27H28N4O3
Exact Mass 456.216141 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2g8pspPJ5Ne
Name N-(2-(1-Benzyl-1H-1,2,3-triazol-4-yl)propan-2-yl)-4,5-dimethoxy-[1,1'-biphenyl]-2-carboxamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H28N4O3
InChI InChI=1S/C27H28N4O3/c1-27(2,25-18-31(30-29-25)17-19-11-7-5-8-12-19)28-26(32)22-16-24(34-4)23(33-3)15-21(22)20-13-9-6-10-14-20/h5-16,18H,17H2,1-4H3,(H,28,32)
InChIKey OFJGLFBBILPTSK-UHFFFAOYSA-N
Literature Reference DOI 10.1002/anie.201311024
Molecular Weight 456.546 g/mol
SMILES N(C(C)(C)c1c[n](nn1)Cc1ccccc1)C(c1c(-c2ccccc2)cc(c(c1)OC)OC)=O
SPLASH splash10-01ox-4040900000-beb2aca05d06bda2750f
Source of Spectrum ACI-53-SMS34-2z
Wiley ID 1782259