| SpectraBase Spectrum ID |
4a2hrdCyXp3 |
| Name |
1-{p-[(1-Adamantyl)oxy]phenyl}pyrrolidine, hydrochloride |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
333.185942225 u |
| Formula |
C20H28ClNO |
| InChI |
InChI=1S/C20H27NO.ClH/c1-2-8-21(7-1)18-3-5-19(6-4-18)22-20-12-15-9-16(13-20)11-17(10-15)14-20;/h3-6,15-17H,1-2,7-14H2;1H/t15-,16+,17-,20-; |
| InChIKey |
QXNVFKOXDIBMFN-LCYOOOSQSA-N |
| SMILES |
C1[C@]2(CC3(C[C@@]1(C[C@@](C2)(C3)[H])[H])OC=1C=CC(=CC1)N1CCCC1)[H].Cl |
| Spectrum/Structure Validation Score (Raman) |
0.899648 |
![1-{p-[(1-Adamantyl)oxy]phenyl}pyrrolidine, hydrochloride](/api/spectrum/4a2hrdCyXp3/structure.png?h=300&w=458 "1-{p-[(1-Adamantyl)oxy]phenyl}pyrrolidine, hydrochloride")
