| SpectraBase Spectrum ID |
3PHvrxjW15G |
| Name |
Acetic acid, trifluoro-, 2-[(2-aminophenyl)thio]cyclohexyl ester, trans- |
| Alternate Name(s) |
1-(2-Aminophenylthio)-2-trifluoroacetoxycyclohexane
2-[(2-aminophenyl)sulfanyl]cyclohexyl trifluoroacetate |
| CAS Registry Number |
98793-10-3 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H16F3NO2S |
| InChI |
InChI=1S/C14H16F3NO2S/c15-14(16,17)13(19)20-10-6-2-4-8-12(10)21-11-7-3-1-5-9(11)18/h1,3,5,7,10,12H,2,4,6,8,18H2 |
| InChIKey |
IQWGPHNUIZUQFQ-UHFFFAOYSA-N |
| Molecular Weight |
319.342 g/mol |
| SMILES |
Nc1c(SC2C(OC(C(F)(F)F)=O)CCCC2)cccc1 |
| SPLASH |
splash10-004i-0904000000-9c9c5660ba4b1b82d388 |
| Source of Spectrum |
KC-1985-1046-9 |
| Wiley ID |
1319196 |
![Acetic acid, trifluoro-, 2-[(2-aminophenyl)thio]cyclohexyl ester, trans-](/api/spectrum/3PHvrxjW15G/structure.png?h=300&w=458 "Acetic acid, trifluoro-, 2-[(2-aminophenyl)thio]cyclohexyl ester, trans-")
