| SpectraBase Spectrum ID |
L4BdPWwiTbd |
| Name |
(E)-1-[2-(Benzylsulfanyl)phenyl]-2-(p-methoxyphenyl)-1-nitroethene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
377.108564647 u |
| Formula |
C22H19NO3S |
| InChI |
InChI=1S/C22H19NO3S/c1-26-19-13-11-17(12-14-19)15-21(23(24)25)20-9-5-6-10-22(20)27-16-18-7-3-2-4-8-18/h2-15H,16H2,1H3/b21-15+ |
| InChIKey |
PLNUQMYAHBYFLH-RCCKNPSSSA-N |
| Molecular Weight |
377.458 g/mol |
| SMILES |
C=1(\C(N(=O)=O)=C/C2=CC=C(OC)C=C2)C(SCC2=CC=CC=C2)=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.907362 |
![(E)-1-[2-(Benzylsulfanyl)phenyl]-2-(p-methoxyphenyl)-1-nitroethene](/api/spectrum/L4BdPWwiTbd/structure.png?h=300&w=458 "(E)-1-[2-(Benzylsulfanyl)phenyl]-2-(p-methoxyphenyl)-1-nitroethene")
