SpectraBase Spectrum ID |
GXmaETIBvtY |
Name |
1,1,1-trifluoro-[2-methyl-6-(methyl-D3)phenyl ester]methanesulfonic acid |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C9H6D3F3O3S |
InChI |
InChI=1S/C9H9F3O3S/c1-6-4-3-5-7(2)8(6)15-16(13,14)9(10,11)12/h3-5H,1-2H3/i1D3 |
InChIKey |
ALJAHPWNRXXSSU-FIBGUPNXSA-N |
Literature Reference DOI |
10.1002/adsc.201000651 |
Molecular Weight |
257.242 g/mol |
SMILES |
c1(OS(=O)(C(F)(F)F)=O)c(cccc1C)C([2D])([2D])[2D] |
SPLASH |
splash10-00di-2910000000-74ddafa6baeb8b201396 |
Source of Spectrum |
ASC-352-3267/SM7-7_2 |
Wiley ID |
1764191 |