| SpectraBase Spectrum ID |
ar61YIn5nP |
| Name |
MDA-19 N-(5-hydroxyhexyl) metabolite |
| Source of Sample |
Cayman Chemical Company |
| Catalog Number |
36039 |
| Lot Number |
0647736-6 |
| Accessory |
DurasamplIR II |
| Apodization Function |
Norton-Beer, medium |
| Comments |
ground on diamond with dichloromethane |
| Copyright |
Copyright © 2019-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H23N3O3 |
| InChI |
InChI=1S/C21H23N3O3/c1-15(25)9-7-8-14-24-18-13-6-5-12-17(18)19(21(24)27)22-23-20(26)16-10-3-2-4-11-16/h2-6,10-13,15,25H,7-9,14H2,1H3,(H,23,26)/b22-19- |
| InChIKey |
ULSASUYONRCCQA-QOCHGBHMSA-N |
| Instrument Name |
Bio-Rad FTS |
| SMILES |
N(C(c1ccccc1)=O)\N=C/1C(N(CCCCC(C)O)c2c1cccc2)=O |
| Source of Spectrum |
Forensic Spectral Research |
| Technique |
ATR-Neat |
