| SpectraBase Spectrum ID |
3svvhX6sFFk |
| Name |
MEP-FUBINACA |
| Source of Sample |
Cayman Chemical Company |
| Catalog Number |
21654 |
| Lot Number |
0521014-2 |
| Apodization Function |
Triangular |
| Carrier Gas |
Nitrogen (1 mL/min) |
| Cell Type |
Flow cell with gold-coated lightpipe (pyrex glass) and KBr windows |
| Copyright |
Copyright © 2022-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Detector |
MCT wideband |
| Formula |
C21H22FN3O3 |
| GC Column |
Supelco SPB-1 (1.8 m x 0.32 mm ID x 0.25 µm film thickness) |
| GC Oven Program |
180 °C (0.30 min hold) - 285 °C (10 °C/min) and 5 min hold |
| IUPAC Name |
Methyl (S)-2-(1-(4-fluorobenzyl)-1H-indazole-3-carboxamido)pentanoate |
| InChI |
InChI=1S/C21H22FN3O3/c1-3-6-17(21(27)28-2)23-20(26)19-16-7-4-5-8-18(16)25(24-19)13-14-9-11-15(22)12-10-14/h4-5,7-12,17H,3,6,13H2,1-2H3,(H,23,26)/t17-/m0/s1 |
| InChIKey |
MFRTXWHFMBIWRY-KRWDZBQOSA-N |
| Inlet Type |
Splitless |
| Instrument Name |
HP 5890 Series II / HP 5965B (GC/IRD) |
| Instrument Properties |
Gram-Schmidt vector orthogonalization
number of basis vectors: 8
number of basis coadditions: 5
vector offset: 60 points
vector length: 100 points |
| Interferogram Mode Name |
Symmetry |
| Molecular Weight |
383.423 g/mol |
| Purity |
>=98% |
| Resolution |
8 cm-1 |
| Source of Spectrum |
Forensic Spectral Research |
| Synonyms |
MMB-FUBINACA isomer 1 |
| Technique |
Vapor Phase |
| UV - Neutral Conditions |
UVmax (nm): 301 |
