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1H-Pyrrole-3-carboxylic acid, 4-[(3,4-dimethoxybenzoyl)amino]-4,5-dihydro-2-methyl-5-oxo-4-(trifluoromethyl)-, ethyl ester
SpectraBase Compound ID BLSPuqgr9iR
InChI InChI=1S/C18H19F3N2O6/c1-5-29-15(25)13-9(2)22-16(26)17(13,18(19,20)21)23-14(24)10-6-7-11(27-3)12(8-10)28-4/h6-8H,5H2,1-4H3,(H,22,26)(H,23,24)
InChIKey HTHWJMJUVSOXKD-UHFFFAOYSA-N
Mol Weight 416.35 g/mol
Molecular Formula C18H19F3N2O6
Exact Mass 416.119521 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8FG3TQgVs8L
Name 1H-Pyrrole-3-carboxylic acid, 4-[(3,4-dimethoxybenzoyl)amino]-4,5-dihydro-2-methyl-5-oxo-4-(trifluoromethyl)-, ethyl ester
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H19F3N2O6
InChI InChI=1S/C18H19F3N2O6/c1-5-29-15(25)13-9(2)22-16(26)17(13,18(19,20)21)23-14(24)10-6-7-11(27-3)12(8-10)28-4/h6-8H,5H2,1-4H3,(H,22,26)(H,23,24)
InChIKey HTHWJMJUVSOXKD-UHFFFAOYSA-N
Molecular Weight 416.353 g/mol
SMILES N1C(C(C(=C1C)C(OCC)=O)(C(F)(F)F)NC(c1cc(c(cc1)OC)OC)=O)=O
SPLASH splash10-014i-4900200000-56103b762fe7d0e0e252
Source of Spectrum IY-1-4604-1
Synonyms 4-[[(3,4-dimethoxyphenyl)-oxomethyl]amino]-2-methyl-5-oxo-4-(trifluoromethyl)-1H-pyrrole-3-carboxylic acid ethyl ester Ethyl 4-[(3,4-dimethoxybenzoyl)amino]-2-methyl-5-oxo-4-(trifluoromethyl)-1H-pyrrole-3-carboxylate Ethyl 4-[(3,4-dimethoxyphenyl)carbonylamino]-2-methyl-5-oxidanylidene-4-(trifluoromethyl)-1H-pyrrole-3-carboxylate
Wiley ID 1654024