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8-CHLORO-1,9B-DIHYDRO-9B-PHENYL-5-(2,2,2-TRIFLUOROETHYL)-3H-AZIRINO-[1,2-D]-[1,4]-BENZODIAZEPIN-4(5H)-ONE
SpectraBase Compound ID 6tTEbwpPy9c
InChI InChI=1S/C18H12Cl3F3N2O/c19-12-6-7-14-13(8-12)17(11-4-2-1-3-5-11)18(20,21)26(17)9-15(27)25(14)10-16(22,23)24/h1-8H,9-10H2/t17-,26?/m0/s1
InChIKey OUFFKFFCHBPRPT-WFFHQLTOSA-N
Mol Weight 435.66 g/mol
Molecular Formula C18H12Cl3F3N2O
Exact Mass 433.996731 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HyeOKoGCfJv
Name 8-CHLORO-1,9B-DIHYDRO-9B-PHENYL-5-(2,2,2-TRIFLUOROETHYL)-3H-AZIRINO-[1,2-D]-[1,4]-BENZODIAZEPIN-4(5H)-ONE
Compound Number 2C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H12Cl3F3N2O
InChI InChI=1S/C18H12Cl3F3N2O/c19-12-6-7-14-13(8-12)17(11-4-2-1-3-5-11)18(20,21)26(17)9-15(27)25(14)10-16(22,23)24/h1-8H,9-10H2/t17-,26?/m0/s1
InChIKey OUFFKFFCHBPRPT-WFFHQLTOSA-N
Literature Reference Author A.CHIMIRRI,S.GRASSO,A.M.MONFORTE,G.ROMEO,M.ZAPPALA
Literature Reference Citation HETEROCYCLES,36,691(1993)
Literature Reference DOI 10.3987/COM-92-6143
Molecular Weight 435.660 g/mol
Solvent CDCl3
Source File Reference UWCP7818