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1-(carbomethoxyamino)-5-hydroxy-2-methyl-4-(2,2,2-trifluoroacetyl)-5-(trifluoromethyl)-2-pyrroline-3-carboxylic acid methyl ester

View entire compound with spectra: 1 MS (GC)

1-(carbomethoxyamino)-5-hydroxy-2-methyl-4-(2,2,2-trifluoroacetyl)-5-(trifluoromethyl)-2-pyrroline-3-carboxylic acid methyl ester
SpectraBase Compound ID CSNktz2ShD
InChI InChI=1S/C12H12F6N2O6/c1-4-5(8(22)25-2)6(7(21)11(13,14)15)10(24,12(16,17)18)20(4)19-9(23)26-3/h6,24H,1-3H3,(H,19,23)
InChIKey GKLCNRDXEJIREL-UHFFFAOYSA-N
Mol Weight 394.23 g/mol
Molecular Formula C12H12F6N2O6
Exact Mass 394.059955 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6p8Se6Q6Eio
Name 1-(carbomethoxyamino)-5-hydroxy-2-methyl-4-(2,2,2-trifluoroacetyl)-5-(trifluoromethyl)-2-pyrroline-3-carboxylic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H12F6N2O6
InChI InChI=1S/C12H12F6N2O6/c1-4-5(8(22)25-2)6(7(21)11(13,14)15)10(24,12(16,17)18)20(4)19-9(23)26-3/h6,24H,1-3H3,(H,19,23)
InChIKey GKLCNRDXEJIREL-UHFFFAOYSA-N
Molecular Weight 394.226 g/mol
SMILES N(N1C(C(C(=C1C)C(=O)OC)C(C(F)(F)F)=O)(C(F)(F)F)O)C(=O)OC
SPLASH splash10-004j-0094000000-5ad2a96e649fc0228346
Source of Spectrum SO-0-1841-4
Synonyms 2-Hydroxy-1-(methoxycarbonylamino)-5-methyl-2-(trifluoromethyl)-3-(2,2,2-trifluoro-1-oxoethyl)-3H-pyrrole-4-carboxylic acid methyl ester Methyl 1-(methoxycarbonylamino)-5-methyl-2-oxidanyl-2-(trifluoromethyl)-3-[2,2,2-tris(fluoranyl)ethanoyl]-3H-pyrrole-4-carboxylate Methyl 2-hydroxy-1-(methoxycarbonylamino)-5-methyl-3-(2,2,2-trifluoroacetyl)-2-(trifluoromethyl)-3H-pyrrole-4-carboxylate
Wiley ID 878705