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1-Benzyl-N-(2-[1-benzyl-1H-1,2,3-triazol-4-yl]propan-2-yl)cyclohexanecarboxamide
SpectraBase Compound ID IyJqTgXSU4p
InChI InChI=1S/C26H32N4O/c1-25(2,23-20-30(29-28-23)19-22-14-8-4-9-15-22)27-24(31)26(16-10-5-11-17-26)18-21-12-6-3-7-13-21/h3-4,6-9,12-15,20H,5,10-11,16-19H2,1-2H3,(H,27,31)
InChIKey CMWRRRPBUXWJNJ-UHFFFAOYSA-N
Mol Weight 416.6 g/mol
Molecular Formula C26H32N4O
Exact Mass 416.257612 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KtAi8R1yh0K
Name 1-Benzyl-N-(2-[1-benzyl-1H-1,2,3-triazol-4-yl]propan-2-yl)cyclohexanecarboxamide
Alternate Name(s) 1-Benzyl-N-(2-(1-benzyl-1H-1,2,3-triazol-4-yl)propan-2-yl)cyclohexane-1-carboxamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H32N4O
InChI InChI=1S/C26H32N4O/c1-25(2,23-20-30(29-28-23)19-22-14-8-4-9-15-22)27-24(31)26(16-10-5-11-17-26)18-21-12-6-3-7-13-21/h3-4,6-9,12-15,20H,5,10-11,16-19H2,1-2H3,(H,27,31)
InChIKey CMWRRRPBUXWJNJ-UHFFFAOYSA-N
Literature Reference DOI 10.1002/anie.201311024
Molecular Weight 416.569 g/mol
SMILES N(C(c1c[n](nn1)Cc1ccccc1)(C)C)C(C1(CCCCC1)Cc1ccccc1)=O
SPLASH splash10-0006-9031200000-2033d4542ad3f0f7ac69
Source of Spectrum ACI-53-SMS40-8g
Wiley ID 1782274