John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=9X5ganhsqzE SpectraBase Spectrum ID=2aVZMhXjNJP

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7-chloro-4-hydroxy-2-(3-methyl-2-phenylmorpholino)-5-phenyl-3H-1,4-benzodiazepinium hydroxide, inner salt
SpectraBase Compound ID 9X5ganhsqzE
InChI InChI=1S/C26H24ClN3O2/c1-18-26(20-10-6-3-7-11-20)32-15-14-29(18)24-17-30(31)25(19-8-4-2-5-9-19)22-16-21(27)12-13-23(22)28-24/h2-13,16,18,26H,14-15,17H2,1H3
InChIKey YUARVGRDCCINBO-UHFFFAOYSA-N
Mol Weight 445.95 g/mol
Molecular Formula C26H24ClN3O2
Exact Mass 445.155705 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 2aVZMhXjNJP
Name 7-CHLORO-4-HYDROXY-2-(3-METHYL-2-PHENYLMORPHOLINO)-5-PHENYL-3H-1,4-BENZODIAZEPINIUM HYDROXIDE, INNER SALT
Source of Sample MAYBRIDGE CHEMICAL COMPANY LTD., NORTH CORNWALL, ENGLAND
Catalog Number DSHS 227
Copyright Copyright © 1980, 1981-2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H24ClN3O2
InChI InChI=1S/C26H24ClN3O2/c1-18-26(20-10-6-3-7-11-20)32-15-14-29(18)24-17-30(31)25(19-8-4-2-5-9-19)22-16-21(27)12-13-23(22)28-24/h2-13,16,18,26H,14-15,17H2,1H3
InChIKey YUARVGRDCCINBO-UHFFFAOYSA-N
Molecular Weight 445.946991
SpectraBase Batch ID FnKQtPGB6LK
Synonyms BENZODIAZEPINIUM HYDROXIDE, 3H-1,4-, 7-CHLORO-4-HYDROXY- 2-/3-METHYL-2-PHENYLMORPHOLINO/- 5-PHENYL-, INNER SALT
Technique KBr WAFER