| SpectraBase Spectrum ID |
1CnyBGQsdqR |
| Name |
MDA, N-HFBP derivative |
| Alternate Name(s) |
(2S)-N-[(1R)-2-(1,3-benzodioxol-5-yl)-1-methylethyl]-1-(2,2,3,3,4,4,4-heptafluorobutanoyl)-2-pyrrolidinecarboxamide |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C19H19F7N2O4 |
| InChI |
InChI=1S/C19H19F7N2O4/c1-10(7-11-4-5-13-14(8-11)32-9-31-13)27-15(29)12-3-2-6-28(12)16(30)17(20,21)18(22,23)19(24,25)26/h4-5,8,10,12H,2-3,6-7,9H2,1H3,(H,27,29)/t10-,12+/m1/s1 |
| InChIKey |
YDKLRUXIUKOZRZ-PWSUYJOCSA-N |
| Molecular Weight |
472.360 g/mol |
| SMILES |
N(C([C@]1(N(C(C(C(C(F)(F)F)(F)F)(F)F)=O)CCC1)[H])=O)[C@@](Cc1cc2OCOc2cc1)(C)[H] |
| SPLASH |
splash10-02t9-0890000000-c0d3496526b5df41461d |
| Source of Spectrum |
O-32-1236-0 |
| Wiley ID |
1393222 |
