| SpectraBase Spectrum ID |
7brWtazvb7i |
| Name |
(Z)-8-(4-Methylphenyl)-5-tosyl-5-azaoct-2-en-7-N-1-ol |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
369.139864776 u |
| Formula |
C21H23NO3S |
| InChI |
InChI=1S/C21H23NO3S/c1-18-7-11-20(12-8-18)6-5-16-22(15-3-4-17-23)26(24,25)21-13-9-19(2)10-14-21/h3-4,7-14,23H,15-17H2,1-2H3/b4-3- |
| InChIKey |
MBDCKPXQNKNGNW-ARJAWSKDSA-N |
| Molecular Weight |
369.479 g/mol |
| SMILES |
C1=CC(C#CCN(S(C2=CC=C(C=C2)C)(=O)=O)C\C=C/CO)=CC=C1C |
