| SpectraBase Spectrum ID |
AVehNedlXfS |
| Name |
jwh-210 4-Hydroxypentyl metabolite, trimethylsilyl ether |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
457.243705904 u |
| Formula |
C29H35NO2Si |
| InChI |
InChI=1S/C29H35NO2Si/c1-6-22-17-18-26(24-14-8-7-13-23(22)24)29(31)27-20-30(28-16-10-9-15-25(27)28)19-11-12-21(2)32-33(3,4)5/h7-10,13-18,20-21H,6,11-12,19H2,1-5H3 |
| InChIKey |
PGRFLTNONRNPQU-UHFFFAOYSA-N |
| Molecular Weight |
457.689 g/mol |
| SMILES |
C(=O)(C=1C2=C(C=CC=C2)N(C1)CCCC(C)O[Si](C)(C)C)C1=C2C(=C(C=C1)CC)C=CC=C2 |
