| SpectraBase Spectrum ID |
5WPIMy0AG0H |
| Name |
JWH-251 4-Methylphenyl isomer |
| Source of Sample |
Cayman Chemical Company |
| Catalog Number |
9001022 |
| Lot Number |
0431194-15 |
| Apodization Function |
Triangular |
| CAS Registry Number |
864445-41-0 |
| 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. |
| Detector |
MCT wideband |
| Formula |
C22H25NO |
| 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 |
2-(4-Methylphenyl)-1-(1-pentyl-1H-indol-3-yl)ethanone |
| InChI |
InChI=1S/C22H25NO/c1-3-4-7-14-23-16-20(19-8-5-6-9-21(19)23)22(24)15-18-12-10-17(2)11-13-18/h5-6,8-13,16H,3-4,7,14-15H2,1-2H3 |
| InChIKey |
GSVYYNBRAJBCQS-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 |
319.448 g/mol |
| Purity |
>=98% |
| Resolution |
8 cm-1 |
| Source of Spectrum |
Forensic Spectral Research |
| Synonyms |
JWH-251 4-Methyl isomer |
| Technique |
Vapor Phase |
| UV - Neutral Conditions |
UVmax (nm): 212, 246, 305 |
