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7-chloro-1-[2-(diethylamino)ethyl]-1,3-dihydro-5-(o-fluorophenyl)-3-hydroxy-2H-1,4-benzodiazepin-2-one
SpectraBase Compound ID wgZBwCOQpg
InChI InChI=1S/C21H23ClFN3O2/c1-3-25(4-2)11-12-26-18-10-9-14(22)13-16(18)19(24-20(27)21(26)28)15-7-5-6-8-17(15)23/h5-10,13,20,27H,3-4,11-12H2,1-2H3
InChIKey BYRATKLXTAPGQQ-UHFFFAOYSA-N
Mol Weight 403.89 g/mol
Molecular Formula C21H23ClFN3O2
Exact Mass 403.146283 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 20AaJ0mRMcJ
Name 7-CHLORO-1-[2-(DIETHYLAMINO)ETHYL]-1,3-DIHYDRO-5-(o-FLUOROPHENYL)-3-HYDROXY-2H-1,4-BENZODIAZEPIN-2-ONE
Source of Sample R. I. Fryer, Hoffmann-La Roche, Inc., Nutley, New Jersey
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H23ClFN3O2
InChI InChI=1S/C21H23ClFN3O2/c1-3-25(4-2)11-12-26-18-10-9-14(22)13-16(18)19(24-20(27)21(26)28)15-7-5-6-8-17(15)23/h5-10,13,20,27H,3-4,11-12H2,1-2H3
InChIKey BYRATKLXTAPGQQ-UHFFFAOYSA-N
Literature Reference JMCH 11, 774(1968)
Melting Point 118-121C
Molecular Weight 403.884003
Synonyms BENZODIAZEPIN-2-ONE, 2H-1,4-, 7- CHLORO-1-/2-/DIETHYLAMINO/ETHYL/-1,3- DIHYDRO-5-/O-FLUOROPHENYL/-3-HYDROXY-,
Technique KBr WAFER