| SpectraBase Spectrum ID |
I6cxqtX9v4k |
| Name |
2-(12-Hydroxymethyltricyclo[8.2.2.24,7]hexadeca-1(13),4(16),5,7(15),10(14),11-hexaen-5-yl)phenol |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
330.161979946 u |
| Formula |
C23H22O2 |
| InChI |
InChI=1S/C23H22O2/c24-15-20-13-16-5-6-17-8-10-19(12-11-18(20)9-7-16)22(14-17)21-3-1-2-4-23(21)25/h1-4,7-10,13-14,24-25H,5-6,11-12,15H2 |
| InChIKey |
NACQBZSHERJVNL-UHFFFAOYSA-N |
| Molecular Weight |
330.427 g/mol |
| SMILES |
C1=C(C2=CC=C1CCC=1C=C(C(CC2)=CC1)C1=CC=CC=C1O)CO |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.821922 |
![4-Hydroxymethyl-13-(2-hydroxyphenyl)-[2.2]paracyclopane](/api/spectrum/I6cxqtX9v4k/structure.png?h=300&w=458 "4-Hydroxymethyl-13-(2-hydroxyphenyl)-[2.2]paracyclopane")
