| SpectraBase Spectrum ID |
GZCElZ3ryL |
| Name |
(Z)-1-(4-Nitroenzoyl)-1-(phenylsulfonyl)-1-hexene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
373.098393885 u |
| Formula |
C19H19NO5S |
| InChI |
InChI=1S/C19H19NO5S/c1-2-3-5-10-18(26(24,25)17-8-6-4-7-9-17)19(21)15-11-13-16(14-12-15)20(22)23/h4,6-14H,2-3,5H2,1H3/b18-10- |
| InChIKey |
HSURSGJNHIGXSC-ZDLGFXPLSA-N |
| Molecular Weight |
373.423 g/mol |
| SMILES |
C(\C(S(=O)(=O)C1=CC=CC=C1)=C\CCCC)(C1=CC=C(N(=O)=O)C=C1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.889158 |
