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1-(N-[2-(5-amino-1-tetrazolyl)-1-oxoethyl]-4-methylanilino)-N-(2,6-dimethylphenyl)-1-cyclohexanecarboxamide
SpectraBase Compound ID GrPrMGPQtlq
InChI InChI=1S/C25H31N7O2/c1-17-10-12-20(13-11-17)32(21(33)16-31-24(26)28-29-30-31)25(14-5-4-6-15-25)23(34)27-22-18(2)8-7-9-19(22)3/h7-13H,4-6,14-16H2,1-3H3,(H,27,34)(H2,26,28,30)
InChIKey CRMOMUFJBONNQA-UHFFFAOYSA-N
Mol Weight 461.57 g/mol
Molecular Formula C25H31N7O2
Exact Mass 461.253923 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GpnYZJYoyys
Name 1-(N-[2-(5-amino-1-tetrazolyl)-1-oxoethyl]-4-methylanilino)-N-(2,6-dimethylphenyl)-1-cyclohexanecarboxamide
Alternate Name(s) 1-(N-[2-(5-aminotetrazol-1-yl)acetyl]-4-methyl-anilino)-N-(2,6-dimethylphenyl)cyclohexanecarboxamide 1-(N-[2-(5-aminotetrazol-1-yl)acetyl]-4-methylanilino)-N-(2,6-dimethylphenyl)cyclohexane-1-carboxamide 1-[2-(5-azanyl-1,2,3,4-tetrazol-1-yl)ethanoyl-(4-methylphenyl)amino]-N-(2,6-dimethylphenyl)cyclohexane-1-carboxamide
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Formula C25H31N7O2
InChI InChI=1S/C25H31N7O2/c1-17-10-12-20(13-11-17)32(21(33)16-31-24(26)28-29-30-31)25(14-5-4-6-15-25)23(34)27-22-18(2)8-7-9-19(22)3/h7-13H,4-6,14-16H2,1-3H3,(H,27,34)(H2,26,28,30)
InChIKey CRMOMUFJBONNQA-UHFFFAOYSA-N
Molecular Weight 461.570 g/mol
SMILES N(C(C1(N(C(C[n]2c(nnn2)N)=O)c2ccc(cc2)C)CCCCC1)=O)c1c(cccc1C)C
SPLASH splash10-000l-4911000000-70b3dbac301ee936ab97
Wiley ID 1464569