| SpectraBase Spectrum ID |
D3M0WFIMY2U |
| Name |
2'-Hydroxyphenyl 3-chloro-3-methylbutanoate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
228.055321976 u |
| Formula |
C11H13ClO3 |
| InChI |
InChI=1S/C11H13ClO3/c1-11(2,12)7-10(14)15-9-6-4-3-5-8(9)13/h3-6,13H,7H2,1-2H3 |
| InChIKey |
RHVGRIFFZUIBKK-UHFFFAOYSA-N |
| Molecular Weight |
228.675 g/mol |
| SMILES |
C(CC(Cl)(C)C)(OC=1C(O)=CC=CC1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.907091 |
