| SpectraBase Spectrum ID |
6jQKFbgZOWE |
| Name |
PFP-acyl derivative of IS |
| Alternate Name(s) |
(+)-trans-3,4,4a,5,6,10b-hexahydro-4-ethyl-9-pentafluoropropionyloxy-2H-naphth[[1,2-b]-(1,4)-oxazine
4-Ethyl-3,4,4a,5,6,10b-hexahydro-2H-naphtho[1,2-b][1,4]oxazin-9-yl 2,2,3,3,3-pentafluoropropanoate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H18F5NO3 |
| InChI |
InChI=1S/C17H18F5NO3/c1-2-23-7-8-25-14-12-9-11(5-3-10(12)4-6-13(14)23)26-15(24)16(18,19)17(20,21)22/h3,5,9,13-14H,2,4,6-8H2,1H3 |
| InChIKey |
GECBYCUOQBDAQT-UHFFFAOYSA-N |
| Molecular Weight |
379.327 g/mol |
| SMILES |
C(C(Oc1cc2C3C(N(CC)CCO3)CCc2cc1)=O)(C(F)(F)F)(F)F |
| SPLASH |
splash10-0gb9-7944000000-ed0d7cb78eb545283de8 |
| Source of Spectrum |
KO-17-296-6 |
| Wiley ID |
1359193 |
