| SpectraBase Spectrum ID |
ARYUbj5t1eH |
| Name |
(Z)-N-(4-Phenylsulfonylbutylidene)-(4Z)-hepta-4,6-dienylamine N-oxime |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
321.139864776 u |
| Formula |
C17H23NO3S |
| InChI |
InChI=1S/C17H23NO3S/c1-2-3-4-5-9-14-18(19)15-10-11-16-22(20,21)17-12-7-6-8-13-17/h2-4,6-8,12-13,15H,1,5,9-11,14,16H2/b4-3-,18-15- |
| InChIKey |
YMJZOHCSHOYFHY-RIYWVADQSA-N |
| Molecular Weight |
321.435 g/mol |
| SMILES |
C1(S(=O)(=O)CCC\C=[N+]\([O-])CCC\C=C/C=C)=CC=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.800087 |
