| SpectraBase Spectrum ID |
3C9JlmqKWXF |
| Name |
2-Methylpropyl ester of 3-(2-methyl-1,3-dithian-2-yl)-5-oxo-3-cyclohexene-1-carboxylic acid |
| CAS Registry Number |
60891-21-6 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H24O3S2 |
| InChI |
InChI=1S/C16H24O3S2/c1-11(2)10-19-15(18)12-7-13(9-14(17)8-12)16(3)20-5-4-6-21-16/h9,11-12H,4-8,10H2,1-3H3 |
| InChIKey |
ZDBMPODTXSATFN-UHFFFAOYSA-N |
| Molecular Weight |
328.485 g/mol |
| SMILES |
C1(C2(SCCCS2)C)=CC(=O)CC(C(OCC(C)C)=O)C1 |
| SPLASH |
splash10-002b-9101000000-961709862a6b02cc5382 |
| Source of Spectrum |
J-45-1252-0 |
| Synonyms |
isobutyl 3-(2-methyl-1,3-dithian-2-yl)-5-oxo-3-cyclohexene-1-carboxylate |
| Wiley ID |
1326043 |
