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N-(2-[1-Benzyl-1H-1,2,3-triazol-4-yl]propan-2-yl)-2-(4-fluorobenzyl)-2-methyl-3-(p-tolyl)propanamide
SpectraBase Compound ID 4lY92IjHDzB
InChI InChI=1S/C30H33FN4O/c1-22-10-12-23(13-11-22)18-30(4,19-24-14-16-26(31)17-15-24)28(36)32-29(2,3)27-21-35(34-33-27)20-25-8-6-5-7-9-25/h5-17,21H,18-20H2,1-4H3,(H,32,36)
InChIKey LMJUHLFAGXASKT-UHFFFAOYSA-N
Mol Weight 484.6 g/mol
Molecular Formula C30H33FN4O
Exact Mass 484.26384 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 91KFDyBthfp
Name N-(2-[1-Benzyl-1H-1,2,3-triazol-4-yl]propan-2-yl)-2-(4-fluorobenzyl)-2-methyl-3-(p-tolyl)propanamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H33FN4O
InChI InChI=1S/C30H33FN4O/c1-22-10-12-23(13-11-22)18-30(4,19-24-14-16-26(31)17-15-24)28(36)32-29(2,3)27-21-35(34-33-27)20-25-8-6-5-7-9-25/h5-17,21H,18-20H2,1-4H3,(H,32,36)
InChIKey LMJUHLFAGXASKT-UHFFFAOYSA-N
Literature Reference DOI 10.1002/anie.201311024
Molecular Weight 484.619 g/mol
SMILES N(C(C(Cc1ccc(cc1)C)(Cc1ccc(cc1)F)C)=O)C(C)(C)c1c[n](nn1)Cc1ccccc1
SPLASH splash10-0006-9633000000-e23f8b50af218c4f8202
Source of Spectrum ACI-53-SMS39-8e
Synonyms N-(2-(1-benzyl-1H-1,2,3-triazol-4-yl)propan-2-yl)-2-(4-fluorobenzyl)-2-methyl-3-(p-tolyl)propanamide
Wiley ID 1782272