| SpectraBase Spectrum ID |
5gxfDKsXmJb |
| Name |
iPDMB-FUBINACA |
| Source of Sample |
Cayman Chemical Company |
| Catalog Number |
28930 |
| Cell Type |
Capillary tube |
| Copyright |
Copyright © 2015-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C24H28FN3O3 |
| IUPAC Name |
Isopropyl (S)-2-(1-(4-fluorobenzyl)-1H-indazole-3-carboxamido)-3,3-dimethylbutanoate |
| InChI |
InChI=1S/C24H28FN3O3/c1-15(2)31-23(30)21(24(3,4)5)26-22(29)20-18-8-6-7-9-19(18)28(27-20)14-16-10-12-17(25)13-11-16/h6-13,15,21H,14H2,1-5H3,(H,26,29)/t21-/m1/s1 |
| InChIKey |
PGZWSBQXIISUMA-OAQYLSRUSA-N |
| Molecular Weight |
425.504 g/mol |
| Purity |
>=98% |
| Raman Corrections |
Referenced to internal white light source; 180 degree backscatter |
| Raman Laser Source |
Nd:YAG |
| SMILES |
N(C(c1c2c([n](n1)Cc1ccc(cc1)F)cccc2)=O)[C@@](C(C)(C)C)(C(OC(C)C)=O)[H] |
| Scans Performed |
1664 |
| Source of Spectrum |
Forensic Spectral Research |
| Technique |
FT-Raman |
