SpectraBase Spectrum ID |
3PpGr3rM4Y6 |
Name |
1-(4-Methoxyphenyl)oct-1-en-3-ol |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
234.161979946 u |
Formula |
C15H22O2 |
InChI |
InChI=1S/C15H22O2/c1-3-4-5-6-14(16)10-7-13-8-11-15(17-2)12-9-13/h7-12,14,16H,3-6H2,1-2H3/b10-7+ |
InChIKey |
PCLCZZVMEIKORT-JXMROGBWSA-N |
Molecular Weight |
234.339 g/mol |
SMILES |
C(\C=C\C=1C=CC(=CC1)OC)(CCCCC)O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.902101 |