For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
8-Chloro-1-(dimethylamino-methyl)-6-phenyl-4H-S-triazolo(4,3-A)(1,4)benzodiazepine N-1-oxide
SpectraBase Compound ID EWPwA48G3j8
InChI InChI=1S/C19H18ClN5O/c1-25(2,26)12-18-23-22-17-11-21-19(13-6-4-3-5-7-13)15-10-14(20)8-9-16(15)24(17)18/h3-10H,11-12H2,1-2H3
InChIKey ITNFSBPMZVUZEZ-UHFFFAOYSA-N
Mol Weight 367.84 g/mol
Molecular Formula C19H18ClN5O
Exact Mass 367.119988 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID CCGWUmg7djK
Name 8-CHLORO-1-(DIMETHYLAMINOMETHYL)-6-PHENYL-4H-S-TRIAZOLO-[4,3-A]-[1,4]-BENZODIAZEPINE-N(1)-OXIDE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H18ClN5O
InChI InChI=1S/C19H18ClN5O/c1-25(2,26)12-18-23-22-17-11-21-19(13-6-4-3-5-7-13)15-10-14(20)8-9-16(15)24(17)18/h3-10H,11-12H2,1-2H3
InChIKey ITNFSBPMZVUZEZ-UHFFFAOYSA-N
Literature Reference Author T.A.SCAHILL,S.L.SMITH
Literature Reference Citation MAGN.RES.CHEM.,23,280(1985)
Literature Reference DOI 10.1002/mrc.1260230415
Molecular Weight 367.838 g/mol
Solvent CDCl3
Source File Reference UNIW15233