| SpectraBase Spectrum ID |
3jSdEqOOH2 |
| Name |
(2S)-tert-Butyl 2-trifluoromethanesulfenyl-5-methoxy-1-oxoindan-2-carboxylate |
| Alternate Name(s) |
tert-Butyl (S)-5-methoxy-1-oxo-2-((trifluoromethyl)thio)-2,3-dihydro-1H-indene-2-carboxylate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H17F3O4S |
| InChI |
InChI=1S/C16H17F3O4S/c1-14(2,3)23-13(21)15(24-16(17,18)19)8-9-7-10(22-4)5-6-11(9)12(15)20/h5-7H,8H2,1-4H3/t15-/m0/s1 |
| InChIKey |
CZCLQAGCQKILRY-HNNXBMFYSA-N |
| Molecular Weight |
362.363 g/mol |
| SMILES |
C(S[C@@]1(C(=O)OC(C)(C)C)Cc2cc(ccc2C1=O)OC)(F)(F)F |
| SPLASH |
splash10-0a4i-4579000000-e4265c2101397d5e0175 |
| Source of Spectrum |
ACI-52-SMS6-arb6 |
| Wiley ID |
1781831 |
