| SpectraBase Spectrum ID |
8QMaDUJkl4r |
| Name |
(3S)-3-(3-Methoxy-4-methylphenyl)butan-1-ol |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
194.130679818 u |
| Formula |
C12H18O2 |
| InChI |
InChI=1S/C12H18O2/c1-9(6-7-13)11-5-4-10(2)12(8-11)14-3/h4-5,8-9,13H,6-7H2,1-3H3/t9-/m0/s1 |
| InChIKey |
ZQHLKMDAHPDGMY-VIFPVBQESA-N |
| Molecular Weight |
194.274 g/mol |
| SMILES |
C=1C(=CC=C(C1OC)C)[C@](CCO)(C)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.976347 |
