SpectraBase Spectrum ID |
9qVcaJJPzqW |
Name |
8-Chloro-6-(phenyl-d5)-4H-benzo[f][1,2,4]triazolo[4,3-a][1,4]diazepine |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C16H6D5ClN4 |
InChI |
InChI=1S/C16H11ClN4/c17-12-6-7-14-13(8-12)16(11-4-2-1-3-5-11)18-9-15-20-19-10-21(14)15/h1-8,10H,9H2/i1D,2D,3D,4D,5D |
InChIKey |
CDCHDCWJMGXXRH-RALIUCGRSA-N |
Literature Reference DOI |
10.1016/j.jchromb.2016.10.042 |
Molecular Weight |
299.776 g/mol |
SMILES |
c1(c(c(c(c(c1[D])[D])[D])C1=NCc2[n](-c3c1cc(cc3)Cl)cnn2)[D])[D] |
SPLASH |
splash10-01ot-2490000000-f75dcf14a96fa73e759d |
Source of Spectrum |
Mariah Carson, et al. Journal of Chromatography B, 10.1016/j.jchromb.2016.10.042 |
Wiley ID |
1816733 |