| SpectraBase Spectrum ID |
5GXu206wZOP |
| Name |
4H-1-Benzothiopyran-4-one, 3-[(2-chloro-1-methyl-1-propenyl)thio]-, (E)- |
| CAS Registry Number |
121926-49-6 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H11ClOS2 |
| InChI |
InChI=1S/C13H11ClOS2/c1-8(14)9(2)17-12-7-16-11-6-4-3-5-10(11)13(12)15/h3-7H,1-2H3/b9-8+ |
| InChIKey |
BMCQMZVSNGLRFI-CMDGGOBGSA-N |
| Molecular Weight |
282.803 g/mol |
| SMILES |
C=1(C(c2ccccc2SC1)=O)S\C(=C/(Cl)C)C |
| SPLASH |
splash10-000f-1900000000-b2bcdb9095076f08ff94 |
| Source of Spectrum |
I-67-378-11 |
| Synonyms |
3-{[(1E)-2-chloro-1-methyl-1-propenyl]sulfanyl}-4H-1-benzothiopyran-4-one
E-3-(2'-chloro-1'-methyl-1'-propenylthio)thiochromone |
| Wiley ID |
1285450 |
![4H-1-Benzothiopyran-4-one, 3-[(2-chloro-1-methyl-1-propenyl)thio]-, (E)-](/api/spectrum/5GXu206wZOP/structure.png?h=300&w=458 "4H-1-Benzothiopyran-4-one, 3-[(2-chloro-1-methyl-1-propenyl)thio]-, (E)-")
