| SpectraBase Spectrum ID |
ATFwSSQVCSS |
| Name |
Cyclohexanecarboxylic acid, 2-methoxy-4-fluoro-5-(ethoxysulfo)phenyl ester |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H21FO5S |
| InChI |
InChI=1S/C16H21FO5S/c1-3-21-23(19)15-10-14(13(20-2)9-12(15)17)22-16(18)11-7-5-4-6-8-11/h9-11H,3-8H2,1-2H3 |
| InChIKey |
KGTNRGKPFYEGAR-UHFFFAOYSA-N |
| Molecular Weight |
344.397 g/mol |
| SMILES |
C1C(CCCC1)C(Oc1c(cc(c(c1)S(=O)OCC)F)OC)=O |
| SPLASH |
splash10-0019-9800000000-3b9fd49d52e0f9cc1958 |
| Source of Spectrum |
TIPS-2023-13-0 |
| Wiley ID |
1884721 |
