| SpectraBase Spectrum ID |
EOqY0OIKwaN |
| Name |
2-[(1-Carboxy-2-oxo-3-cyclohexenyl)propylidene]-1,3-dithiolane |
| Alternate Name(s) |
4-(1-cyclohexen-1-yl)-2-(1,3-dithiolan-2-ylidene)-3-oxobutanoic acid |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H16O3S2 |
| InChI |
InChI=1S/C13H16O3S2/c14-10(8-9-4-2-1-3-5-9)11(12(15)16)13-17-6-7-18-13/h4H,1-3,5-8H2,(H,15,16) |
| InChIKey |
GPYRCGNBXREPFO-UHFFFAOYSA-N |
| Molecular Weight |
284.388 g/mol |
| SMILES |
OC(C(=C1SCCS1)C(CC1=CCCCC1)=O)=O |
| SPLASH |
splash10-001l-0090000000-c8181b24324675eb5d50 |
| Source of Spectrum |
SO-0-16-4 |
| Wiley ID |
1541941 |
![2-[(1-Carboxy-2-oxo-3-cyclohexenyl)propylidene]-1,3-dithiolane](/api/spectrum/EOqY0OIKwaN/structure.png?h=300&w=458 "2-[(1-Carboxy-2-oxo-3-cyclohexenyl)propylidene]-1,3-dithiolane")
