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1H-Pyrrole-3-carboxylic acid, 1-cyclohexyl-4-[(3-cyclohexyl-1-oxopropyl)amino]-4,5-dihydro-2-methyl-5-oxo-4-(trifluoromethyl)-, methyl ester
SpectraBase Compound ID AoPeWxMqS1j
InChI InChI=1S/C23H33F3N2O4/c1-15-19(20(30)32-2)22(23(24,25)26,21(31)28(15)17-11-7-4-8-12-17)27-18(29)14-13-16-9-5-3-6-10-16/h16-17H,3-14H2,1-2H3,(H,27,29)
InChIKey APLMTXGILAUFRG-UHFFFAOYSA-N
Mol Weight 458.5 g/mol
Molecular Formula C23H33F3N2O4
Exact Mass 458.239242 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3jsumObZd5J
Name 1H-Pyrrole-3-carboxylic acid, 1-cyclohexyl-4-[(3-cyclohexyl-1-oxopropyl)amino]-4,5-dihydro-2-methyl-5-oxo-4-(trifluoromethyl)-, methyl ester
Alternate Name(s) Methyl 1-cyclohexyl-4-(3-cyclohexylpropanamido)-2-methyl-5-oxo-4-(trifluoromethyl)-4,5-dihydro-1H-pyrrole-3-carboxylate 1-cyclohexyl-4-[(3-cyclohexyl-1-oxopropyl)amino]-2-methyl-5-oxo-4-(trifluoromethyl)-3-pyrrolecarboxylic acid methyl ester Methyl 1-cyclohexyl-4-(3-cyclohexylpropanoylamino)-2-methyl-5-oxo-4-(trifluoromethyl)pyrrole-3-carboxylate Methyl 1-cyclohexyl-4-(3-cyclohexylpropanoylamino)-2-methyl-5-oxidanylidene-4-(trifluoromethyl)pyrrole-3-carboxylate
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Formula C23H33F3N2O4
InChI InChI=1S/C23H33F3N2O4/c1-15-19(20(30)32-2)22(23(24,25)26,21(31)28(15)17-11-7-4-8-12-17)27-18(29)14-13-16-9-5-3-6-10-16/h16-17H,3-14H2,1-2H3,(H,27,29)
InChIKey APLMTXGILAUFRG-UHFFFAOYSA-N
Molecular Weight 458.522 g/mol
SMILES N(C1(C(N(C(=C1C(=O)OC)C)C1CCCCC1)=O)C(F)(F)F)C(=O)CCC1CCCCC1
SPLASH splash10-0a4i-9221000000-1c17af24f8c5006e7ad4
Source of Spectrum IY-2-5036-8
Wiley ID 1658351