| SpectraBase Spectrum ID |
CoMVzMnWPBO |
| Name |
MDMB-FUBICA metabolite 3 |
| Alternate Name(s) |
(S)-2-(1-(4-fluorobenzyl)-1H-indole-3-carboxamido)-3,3-dimethylbutanoic acid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H23FN2O3 |
| InChI |
InChI=1S/C22H23FN2O3/c1-22(2,3)19(21(27)28)24-20(26)17-13-25(18-7-5-4-6-16(17)18)12-14-8-10-15(23)11-9-14/h4-11,13,19H,12H2,1-3H3,(H,24,26)(H,27,28)/t19-/m1/s1 |
| InChIKey |
PZPKPULZRMBYJZ-LJQANCHMSA-N |
| Molecular Weight |
382.435 g/mol |
| SMILES |
N(C(=O)c1c[n](Cc2ccc(F)cc2)c2c1cccc2)[C@](C(O)=O)(C(C)(C)C)[H] |
| SPLASH |
splash10-0a4i-2935000000-22c4081851b7cb144b68 |
| Source of Spectrum |
SWG-33-4596-0 |
| Wiley ID |
1811194 |
