| SpectraBase Spectrum ID |
HzyksPGksqt |
| Name |
(E,Z)-2-Methyl-3-nitro-1-[2-(phenylthio)ethenyl]benzene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
271.066699835 u |
| Formula |
C15H13NO2S |
| InChI |
InChI=1S/C15H13NO2S/c1-12-13(6-5-9-15(12)16(17)18)10-11-19-14-7-3-2-4-8-14/h2-11H,1H3/b11-10+ |
| InChIKey |
QQLSITVJUPYXQD-ZHACJKMWSA-N |
| SMILES |
C1(N(=O)=O)=C(C(\C=C\SC=2C=CC=CC2)=CC=C1)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.818464 |
![(E,Z)-2-Methyl-3-nitro-1-[2-(phenylthio)ethenyl]benzene](/api/spectrum/HzyksPGksqt/structure.png?h=300&w=458 "(E,Z)-2-Methyl-3-nitro-1-[2-(phenylthio)ethenyl]benzene")
