| SpectraBase Spectrum ID |
JiYnVAiguMA |
| Name |
2,3,3,4,4,4-hexafluorobutanethioic acid S-(3-mercaptopropyl) ester |
| Alternate Name(s) |
S-(3-sulfanylpropyl) 2,3,3,4,4,4-hexafluorobutanethioate
S-(3-sulfanylpropyl) 2,3,3,4,4,4-hexakis(fluoranyl)butanethioate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C7H8F6OS2 |
| InChI |
InChI=1S/C7H8F6OS2/c8-4(5(14)16-3-1-2-15)6(9,10)7(11,12)13/h4,15H,1-3H2 |
| InChIKey |
KCDIWUGCIFBSMF-UHFFFAOYSA-N |
| Molecular Weight |
286.250 g/mol |
| SMILES |
SCCCSC(C(C(C(F)(F)F)(F)F)F)=O |
| SPLASH |
splash10-014i-0090000000-d51815bd06e2c3a20486 |
| Source of Spectrum |
J-58-31-6 |
| Wiley ID |
1289240 |
