| SpectraBase Spectrum ID |
L25b58CJ2m3 |
| Name |
2-[(trifluoromethyl)thio]acetic acid 4-nitrobenzyl ester |
| Appearance |
Yellow oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
295.012613401 u |
| Formula |
C10H8F3NO4S |
| InChI |
InChI=1S/C10H8F3NO4S/c11-10(12,13)19-6-9(15)18-5-7-1-3-8(4-2-7)14(16)17/h1-4H,5-6H2 |
| InChIKey |
BDBWHIHEURRQMA-UHFFFAOYSA-N |
| Instrument Name |
Varian Saturn 2100 T |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.201602730 |
| Molecular Weight |
295.232 g/mol |
| Quality |
87 |
| Reported Formula |
C10H8F3O4SN |
| SMILES |
C(SCC(OCC1=CC=C(C=C1)[N+](=O)[O-])=O)(F)(F)F |
| SPLASH |
splash10-000i-0900000000-288e74bfe37f7a747ac5 |
| Source of Spectrum |
QE-22-SM26-2aa (DOI: 10.1002/chem.201602730) |
| Wiley ID |
1904990 |
![2-[(trifluoromethyl)thio]acetic acid 4-nitrobenzyl ester](/api/spectrum/L25b58CJ2m3/structure.png?h=300&w=458 "2-[(trifluoromethyl)thio]acetic acid 4-nitrobenzyl ester")
