SpectraBase Spectrum ID |
2SOwNkOO4En |
Name |
2-[N-(2-Phenylethyl)-N-(trifluoromethanesulfonyl)amino]ethanoic acid |
Comments |
Less than 3 mono-isotopic peaks |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C11H12F3NO4S |
InChI |
InChI=1S/C11H12F3NO4S/c12-11(13,14)20(18,19)15(8-10(16)17)7-6-9-4-2-1-3-5-9/h1-5H,6-8H2,(H,16,17) |
InChIKey |
LDODHQWTKKIAKH-UHFFFAOYSA-N |
Molecular Weight |
311.275 g/mol |
SMILES |
OC(CN(S(C(F)(F)F)(=O)=O)CCc1ccccc1)=O |
SPLASH |
splash10-0udi-0900000000-6bcfb1e2014a8093dbd6 |
Source of Spectrum |
H1-45-1125-1 |
Synonyms |
2-[N-(2-Phenylethyl)-N-(trifluoromethanesulfonyl)amido]ethanoic acid
{(2-phenylethyl)[(trifluoromethyl)sulfonyl]amino}acetic acid |
Wiley ID |
758305 |