SpectraBase Spectrum ID |
KrVzXWnMaxE |
Name |
5-Fluoro EDMB-PINACA |
Source of Sample |
Cayman Chemical Company |
Catalog Number |
23005 |
Lot Number |
0516373-14 |
Cell Type |
Capillary tube |
Compound Type |
Pure |
Copyright |
Copyright © 2015-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C21H30FN3O3 |
IUPAC Name |
Ethyl (S)-2-(1-(5-fluoropentyl)-1H-indazole-3-carboxamido)-3,3-dimethylbutanoate |
InChI |
InChI=1S/C21H30FN3O3/c1-5-28-20(27)18(21(2,3)4)23-19(26)17-15-11-7-8-12-16(15)25(24-17)14-10-6-9-13-22/h7-8,11-12,18H,5-6,9-10,13-14H2,1-4H3,(H,23,26)/t18-/m1/s1 |
InChIKey |
VDEACSPMBSUVRD-GOSISDBHSA-N |
Raman Corrections |
Referenced to internal white light source; 180 degree backscatter |
Raman Laser Power |
1401 mW |
Raman Laser Source |
Nd:YAG |
SMILES |
N(C(c1c2ccccc2[n](n1)CCCCCF)=O)[C@](C(OCC)=O)(C(C)(C)C)[H] |
Scans Performed |
2880 |
Source of Spectrum |
Forensic Spectral Research |
Technique |
FT-Raman |