| SpectraBase Spectrum ID |
1xrqi6ljVIB |
| Name |
1-Chloro-3-(1-hexynyl)-4-hydroxy-2-methoxynaphthalene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
288.091707485 u |
| Formula |
C17H17ClO2 |
| InChI |
InChI=1S/C17H17ClO2/c1-3-4-5-6-11-14-16(19)13-10-8-7-9-12(13)15(18)17(14)20-2/h7-10,19H,3-5H2,1-2H3 |
| InChIKey |
CCEUDIZZGIZWAK-UHFFFAOYSA-N |
| SMILES |
C1(=C(C(Cl)=C2C(=C1O)C=CC=C2)OC)C#CCCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.862029 |
