SpectraBase Spectrum ID |
EmnPQiOpmZl |
Name |
2-Phenyl-4-[2H2]phenyl-2H-1,2,3,5-thiatriazol-1-ium chloride |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C13H5D5ClN3S |
InChI |
InChI=1S/C13H10N3S.ClH/c1-3-7-11(8-4-1)13-14-16(17-15-13)12-9-5-2-6-10-12;/h1-10H;1H/q+1;/p-1/i1D,3D,4D,7D,8D; |
InChIKey |
QNOFUUBDZSSYQY-VTEWAWCOSA-M |
Molecular Weight |
280.788 g/mol |
SMILES |
[Cl-].c1(n[n](-c2ccccc2)[s+]n1)-c1c(c([D])c(c(c1[D])[D])[D])[D] |
SPLASH |
splash10-0a6r-6910000000-3cc2e7ca3279e4ad1341 |
Source of Spectrum |
KC-0-1624-6 |
Wiley ID |
820547 |