| SpectraBase Spectrum ID |
B9IJszmOvmX |
| Name |
t-Butyl 2-[2'-(4"-chlorophenyl)-3',3'-dicyano)allylidene)-perhydro-1,3-thiazine-3-carboxylate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H20ClN3O2S |
| InChI |
InChI=1S/C20H20ClN3O2S/c1-20(2,3)26-19(25)24-9-8-17(27-13-24)10-18(15(11-22)12-23)14-4-6-16(21)7-5-14/h4-7,10H,8-9,13H2,1-3H3/b17-10- |
| InChIKey |
LCOZYNUWHYKXJS-YVLHZVERSA-N |
| Molecular Weight |
401.912 g/mol |
| SMILES |
C(N1CS\C(=C/C(=C(C#N)C#N)c2ccc(cc2)Cl)CC1)(OC(C)(C)C)=O |
| SPLASH |
splash10-0udi-0009000000-6244b212972f83598f19 |
| Source of Spectrum |
Y-33-1793-5 |
| Synonyms |
tert-butyl (6Z)-6-[2-(4-chlorophenyl)-3,3-dicyano-2-propenylidene]dihydro-2H-1,3-thiazine-3(4H)-carboxylate |
| Wiley ID |
1369937 |
