SpectraBase Spectrum ID |
5q1e4Nf1UzH |
Name |
AM694 |
Source of Sample |
Cayman Chemical Company |
Catalog Number |
15720 |
Lot Number |
0467139-1 |
Apodization Function |
Triangular |
CAS Registry Number |
335161-03-0 |
Carrier Gas |
Nitrogen (1 mL/min) |
Cell Type |
Flow cell with gold-coated lightpipe (pyrex glass) and KBr windows |
Copyright |
Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
DEA Citation |
21 CFR §1308.11 (g) (12) |
DEA Controlled Substance Name |
1-(5-fluoropentyl)-3-(2-iodobenzoyl)indole |
DEA Controlled Substance Type |
Salts, isomers, and salts of isomers |
DEA Controlled Substances Code Number |
7694 |
DEA Schedule |
Schedule I |
DEA Section |
Cannabimimetic agents. Unless specifically exempted or unless listed in another schedule, any material, compound, mixture, or preparation which contains any quantity of the following substances, or which contains their salts, isomers, and salts of isomers whenever the existence of such salts, isomers, and salts of isomers is possible within the specific chemical designation. |
Detector |
MCT wideband |
Formula |
C20H19FINO |
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 |
[1-(5-Fluoropentyl)-1H-indol-3-yl](2-iodophenyl)methanone |
InChI |
InChI=1S/C20H19FINO/c21-12-6-1-7-13-23-14-17(15-8-3-5-11-19(15)23)20(24)16-9-2-4-10-18(16)22/h2-5,8-11,14H,1,6-7,12-13H2 |
InChIKey |
LFFIIZFINPPEMC-UHFFFAOYSA-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 |
435.281 g/mol |
Purity |
>=95% |
Resolution |
8 cm-1 |
Source of Spectrum |
Forensic Spectral Research |
Technique |
Vapor Phase |
UV - Neutral Conditions |
UVmax (nm): 213, 251, 315 |