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4-methoxy-N-methyl-N-[4-oxidanyl-2-oxidanylidene-4-(trifluoromethyl)-3,5-dihydro-1H-1,5-benzodiazepin-3-yl]benzamide
SpectraBase Compound ID LCSaTMW59dD
InChI InChI=1S/C19H18F3N3O4/c1-25(17(27)11-7-9-12(29-2)10-8-11)15-16(26)23-13-5-3-4-6-14(13)24-18(15,28)19(20,21)22/h3-10,15,24,28H,1-2H3,(H,23,26)
InChIKey JHOKQFVNBNLXNO-UHFFFAOYSA-N
Mol Weight 409.37 g/mol
Molecular Formula C19H18F3N3O4
Exact Mass 409.124941 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BLouCcLHr89
Name 4-methoxy-N-methyl-N-[4-oxidanyl-2-oxidanylidene-4-(trifluoromethyl)-3,5-dihydro-1H-1,5-benzodiazepin-3-yl]benzamide
Comments Less than 3 mono-isotopic peaks
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Formula C19H18F3N3O4
InChI InChI=1S/C19H18F3N3O4/c1-25(17(27)11-7-9-12(29-2)10-8-11)15-16(26)23-13-5-3-4-6-14(13)24-18(15,28)19(20,21)22/h3-10,15,24,28H,1-2H3,(H,23,26)
InChIKey JHOKQFVNBNLXNO-UHFFFAOYSA-N
Molecular Weight 409.365 g/mol
SMILES N1c2c(NC(C(C1=O)N(C(c1ccc(cc1)OC)=O)C)(C(F)(F)F)O)cccc2
SPLASH splash10-000i-0900000000-47161b300db8b9e32da2
Source of Spectrum O1-55-1923-3
Synonyms N-[4-hydroxy-2-keto-4-(trifluoromethyl)-3,5-dihydro-1H-1,5-benzodiazepin-3-yl]-4-methoxy-N-methyl-benzamide N-[4-hydroxy-2-oxo-4-(trifluoromethyl)-3,5-dihydro-1H-1,5-benzodiazepin-3-yl]-4-methoxy-N-methyl-benzamide
Wiley ID 1591380