SpectraBase Spectrum ID |
AGIOJ31bXzT |
Name |
2-(4-Nitrophenyl)-1,4,6,7-tetrahydrothiopyrano[4,3-c]pyrazol-3(2H)-one |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C12H11N3O3S |
InChI |
InChI=1S/C12H11N3O3S/c16-12-10-7-19-6-5-11(10)13-14(12)8-1-3-9(4-2-8)15(17)18/h1-4,13H,5-7H2 |
InChIKey |
GYAIWXPHSKJCSN-UHFFFAOYSA-N |
Literature Reference DOI |
10.1002/jccs.201800276 |
Molecular Weight |
277.298 g/mol |
SMILES |
N1C2=C(C(N1c1ccc(cc1)[N+](=O)[O-])=O)CSCC2 |
SPLASH |
splash10-004i-6390000000-4b4e0a1053abce321588 |
Source of Spectrum |
QA-66-SM12-18c |
Wiley ID |
1819631 |