| SpectraBase Spectrum ID |
GmR7w6ztmI9 |
| Name |
8-[(4-Hydroxy-3-methoxyphenyl)methyl]-3,6-diazatricyclo[4.3.1.1(3,8)]undecan-1-ol |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
304.178692638 u |
| Formula |
C17H24N2O3 |
| InChI |
InChI=1S/C17H24N2O3/c1-22-15-6-13(2-3-14(15)20)7-16-8-17(21)11-18(9-16)4-5-19(10-16)12-17/h2-3,6,20-21H,4-5,7-12H2,1H3/t16-,17- |
| InChIKey |
DZKYAZNWWBLOLN-QAQDUYKDSA-N |
| Molecular Weight |
304.390 g/mol |
| SMILES |
C1[C@]2(CN3C[C@](C2)(CN1CC3)CC=1C=C(OC)C(=CC1)O)O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.937343 |
![8-[(4-Hydroxy-3-methoxyphenyl)methyl]-3,6-diazatricyclo[4.3.1.1(3,8)]undecan-1-ol](/api/spectrum/GmR7w6ztmI9/structure.png?h=300&w=458 "8-[(4-Hydroxy-3-methoxyphenyl)methyl]-3,6-diazatricyclo[4.3.1.1(3,8)]undecan-1-ol")
