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2-Propenoic acid, 2-(benzoylamino)-3-(4,5,6,7-tetrafluoro-1H-indol-3-yl)-, methyl ester, (Z)-
SpectraBase Compound ID CXMUGawIQy9
InChI InChI=1S/C19H12F4N2O3/c1-28-19(27)11(25-18(26)9-5-3-2-4-6-9)7-10-8-24-17-12(10)13(20)14(21)15(22)16(17)23/h2-8,24H,1H3,(H,25,26)/b11-7-
InChIKey ZTUWCEMWIJHMMA-XFFZJAGNSA-N
Mol Weight 392.31 g/mol
Molecular Formula C19H12F4N2O3
Exact Mass 392.078405 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GS3OE6M3HXx
Name 2-Propenoic acid, 2-(benzoylamino)-3-(4,5,6,7-tetrafluoro-1H-indol-3-yl)-, methyl ester, (Z)-
CAS Registry Number 122490-01-1
Comments Less than 3 mono-isotopic peaks
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Formula C19H12F4N2O3
InChI InChI=1S/C19H12F4N2O3/c1-28-19(27)11(25-18(26)9-5-3-2-4-6-9)7-10-8-24-17-12(10)13(20)14(21)15(22)16(17)23/h2-8,24H,1H3,(H,25,26)/b11-7-
InChIKey ZTUWCEMWIJHMMA-XFFZJAGNSA-N
Molecular Weight 392.310 g/mol
SMILES [nH]1cc(\C=C/(NC(=O)c2ccccc2)C(=O)OC)c2c1c(F)c(c(c2F)F)F
SPLASH splash10-0a4i-0900000000-223f7dc6688440045d57
Source of Spectrum J-54-4521-32
Synonyms methyl (2Z)-2-(benzoylamino)-3-(4,5,6,7-tetrafluoro-1H-indol-3-yl)-2-propenoate Methyl (Z)-2-benzamido-3-(4,5,6,7-tetrafluoroindolyl)-2-propenoate
Wiley ID 1365666