| SpectraBase Spectrum ID |
2bJVSImSEXM |
| Name |
(1S,2R)-2-Acetoxycyclopentyl (S)-.alpha.-Methoxy-.alpha.-(trifluoro)methylphenylacetate |
| Alternate Name(s) |
(1S,2R)-2-(acetyloxy)cyclopentyl (2S)-3,3,3-trifluoro-2-methoxy-2-phenylpropanoate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H19F3O5 |
| InChI |
InChI=1S/C17H19F3O5/c1-11(21)24-13-9-6-10-14(13)25-15(22)16(23-2,17(18,19)20)12-7-4-3-5-8-12/h3-5,7-8,13-14H,6,9-10H2,1-2H3/t13-,14+,16+/m1/s1 |
| InChIKey |
WGDTXEPILZBUPT-YCPHGPKFSA-N |
| Molecular Weight |
360.329 g/mol |
| SMILES |
[C@](C(O[C@@]1([C@](OC(=O)C)(CCC1)[H])[H])=O)(C(F)(F)F)(c1ccccc1)OC |
| SPLASH |
splash10-000i-0900000000-481080799fc053394888 |
| Source of Spectrum |
F-52-6537-9 |
| Wiley ID |
796593 |
