| SpectraBase Spectrum ID |
7dvQ1O5tnT1 |
| Name |
4-Chloro-2-methoxybenzyl alcohol, N-pentyl ether |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
242.107357550 u |
| Formula |
C13H19ClO2 |
| InChI |
InChI=1S/C13H19ClO2/c1-3-4-5-8-16-10-11-6-7-12(14)9-13(11)15-2/h6-7,9H,3-5,8,10H2,1-2H3 |
| InChIKey |
CMCSLVNXFIRQHP-UHFFFAOYSA-N |
| Molecular Weight |
242.746 g/mol |
| SMILES |
C1=C(C=CC(=C1OC)COCCCCC)Cl |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.893326 |
