| SpectraBase Spectrum ID |
1dkysjG3iLD |
| Name |
1-[2-(2-Hydroxymethyl-4-methoxyphenyl)-1-ethynyl]-2-naphthylmethanol |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
318.125594437 u |
| Formula |
C21H18O3 |
| InChI |
InChI=1S/C21H18O3/c1-24-19-10-8-15(18(12-19)14-23)9-11-21-17(13-22)7-6-16-4-2-3-5-20(16)21/h2-8,10,12,22-23H,13-14H2,1H3 |
| InChIKey |
AAWFXSKCISOZMD-UHFFFAOYSA-N |
| Molecular Weight |
318.372 g/mol |
| SMILES |
C(#CC1=C(C=C(C=C1)OC)CO)C=1C2=C(C=CC=C2)C=CC1CO |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.945188 |
![1-[2-(2-Hydroxymethyl-4-methoxyphenyl)-1-ethynyl]-2-naphthylmethanol](/api/spectrum/1dkysjG3iLD/structure.png?h=300&w=458 "1-[2-(2-Hydroxymethyl-4-methoxyphenyl)-1-ethynyl]-2-naphthylmethanol")
