| SpectraBase Spectrum ID |
8psh2rCJOlx |
| Name |
(S)-1-[2-(4'-Methylphenoxy)phenyl]-1-propanol |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
242.130679818 u |
| Formula |
C16H18O2 |
| InChI |
InChI=1S/C16H18O2/c1-3-15(17)14-6-4-5-7-16(14)18-13-10-8-12(2)9-11-13/h4-11,15,17H,3H2,1-2H3/t15-/m0/s1 |
| InChIKey |
NKUBWCSASQIQQZ-HNNXBMFYSA-N |
| Molecular Weight |
242.318 g/mol |
| SMILES |
C=1(C(OC=2C=CC(=CC2)C)=CC=CC1)[C@@](O)(CC)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.893489 |
![(S)-1-[2-(4'-methylphenoxy)phenyl]-1-propanol](/api/spectrum/8psh2rCJOlx/structure.png?h=300&w=458 "(S)-1-[2-(4'-methylphenoxy)phenyl]-1-propanol")
