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1-[2-(3-azanyl-1H-1,2,4-triazol-5-yl)ethanoylamino]-N-phenyl-cyclohexane-1-carboxamide
SpectraBase Compound ID J7hzj1OLf6C
InChI InChI=1S/C17H22N6O2/c18-16-20-13(22-23-16)11-14(24)21-17(9-5-2-6-10-17)15(25)19-12-7-3-1-4-8-12/h1,3-4,7-8H,2,5-6,9-11H2,(H,19,25)(H,21,24)(H3,18,20,22,23)
InChIKey WGBQJDLTLXGDAR-UHFFFAOYSA-N
Mol Weight 342.4 g/mol
Molecular Formula C17H22N6O2
Exact Mass 342.180424 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GfThbZBxE11
Name 1-[2-(3-azanyl-1H-1,2,4-triazol-5-yl)ethanoylamino]-N-phenyl-cyclohexane-1-carboxamide
Alternate Name(s) 1-[[2-(3-amino-1H-1,2,4-triazol-5-yl)-1-oxoethyl]amino]-N-phenyl-1-cyclohexanecarboxamide 1-[[2-(3-amino-1H-1,2,4-triazol-5-yl)acetyl]amino]-N-phenyl-cyclohexanecarboxamide 1-[[2-(3-amino-1H-1,2,4-triazol-5-yl)acetyl]amino]-N-phenylcyclohexane-1-carboxamide 1-{[(3-amino-1H-1,2,4-triazol-5-yl)acetyl]amino}-N-phenylcyclohexanecarboxamide
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Formula C17H22N6O2
InChI InChI=1S/C17H22N6O2/c18-16-20-13(22-23-16)11-14(24)21-17(9-5-2-6-10-17)15(25)19-12-7-3-1-4-8-12/h1,3-4,7-8H,2,5-6,9-11H2,(H,19,25)(H,21,24)(H3,18,20,22,23)
InChIKey WGBQJDLTLXGDAR-UHFFFAOYSA-N
Molecular Weight 342.403 g/mol
SMILES N(C(C1(NC(Cc2nc(n[nH]2)N)=O)CCCCC1)=O)c1ccccc1
SPLASH splash10-006t-9350000000-8b8af8a31540fc0729f3
Wiley ID 1442666