| SpectraBase Spectrum ID |
2EOpp8JupBV |
| Name |
1,2-Butanedione, 1-[6-[2-(2-thioxo-1-pyrrolidinyl)ethyl]-1,3-benzodioxol-5-yl]- |
| CAS Registry Number |
124021-97-2 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H19NO4S |
| InChI |
InChI=1S/C17H19NO4S/c1-2-13(19)17(20)12-9-15-14(21-10-22-15)8-11(12)5-7-18-6-3-4-16(18)23/h8-9H,2-7,10H2,1H3 |
| InChIKey |
HBDNGYLUBKMXFS-UHFFFAOYSA-N |
| Molecular Weight |
333.402 g/mol |
| SMILES |
c1(C(C(=O)CC)=O)c(cc2c(c1)OCO2)CCN1C(=S)CCC1 |
| SPLASH |
splash10-004i-0952000000-bce91be98680576350db |
| Source of Spectrum |
J-55-837-41 |
| Synonyms |
1-{6-[2-(2-thioxo-1-pyrrolidinyl)ethyl]-1,3-benzodioxol-5-yl}-1,2-butanedione |
| Wiley ID |
1330157 |
![1,2-Butanedione, 1-[6-[2-(2-thioxo-1-pyrrolidinyl)ethyl]-1,3-benzodioxol-5-yl]-](/api/spectrum/2EOpp8JupBV/structure.png?h=300&w=458 "1,2-Butanedione, 1-[6-[2-(2-thioxo-1-pyrrolidinyl)ethyl]-1,3-benzodioxol-5-yl]-")
