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(11aS)-7-(3-Trifluoromethylphenyl)-10-methyl-2,3-dihydro-1H-benzo[e]pyrrolo[1,2-a][1,4]diazepine-5,11-(10H,11aH)-dione
SpectraBase Compound ID GoaVtgQhwfd
InChI InChI=1S/C20H17F3N2O2/c1-24-16-8-7-13(12-4-2-5-14(10-12)20(21,22)23)11-15(16)18(26)25-9-3-6-17(25)19(24)27/h2,4-5,7-8,10-11,17H,3,6,9H2,1H3/t17-/m0/s1
InChIKey QYHTYDSOURCAEL-KRWDZBQOSA-N
Mol Weight 374.36 g/mol
Molecular Formula C20H17F3N2O2
Exact Mass 374.124212 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AeBE9EbGkOJ
Name (11aS)-7-(3-Trifluoromethylphenyl)-10-methyl-2,3-dihydro-1H-benzo[e]pyrrolo[1,2-a][1,4]diazepine-5,11-(10H,11aH)-dione
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Formula C20H17F3N2O2
InChI InChI=1S/C20H17F3N2O2/c1-24-16-8-7-13(12-4-2-5-14(10-12)20(21,22)23)11-15(16)18(26)25-9-3-6-17(25)19(24)27/h2,4-5,7-8,10-11,17H,3,6,9H2,1H3/t17-/m0/s1
InChIKey QYHTYDSOURCAEL-KRWDZBQOSA-N
Molecular Weight 374.363 g/mol
SMILES c12C(N3[C@](CCC3)([H])C(N(c1ccc(c2)-c1cc(C(F)(F)F)ccc1)C)=O)=O
SPLASH splash10-053r-9048000000-d1f5d33d944352bd9474
Source of Spectrum Y-51-428-7f
Synonyms (S)-10-methyl-7-(3-(trifluoromethyl)phenyl)-2,3-dihydro-1H-benzo[e]pyrrolo[1,2-a][1,4]diazepine-5,11(10H,11aH)-dione
Wiley ID 1741253