| SpectraBase Spectrum ID |
5TWotrPRyMn |
| Name |
T-Butyl 2-(3',3'-dicyano-2'-(4''-methylphenyl)allylidene)-perhydro-1,3-thiazine-3-carboxylate |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
381.151098165 u |
| Formula |
C21H23N3O2S |
| InChI |
InChI=1S/C21H23N3O2S/c1-15-6-8-16(9-7-15)18(17(13-22)14-23)12-19-24(10-5-11-27-19)20(25)26-21(2,3)4/h6-9,12H,5,10-11H2,1-4H3/b19-12- |
| InChIKey |
HHTGVVJAKHQKPS-UNOMPAQXSA-N |
| Molecular Weight |
381.494 g/mol |
| SMILES |
C(\C=C\1N(CCCS1)C(OC(C)(C)C)=O)(=C(C#N)C#N)C1=CC=C(C=C1)C |
