| SpectraBase Compound ID | 79Hh1Mz2VVN |
|---|---|
| InChI | InChI=1S/C9H10O2/c1-2-9(11)7-4-3-5-8(10)6-7/h3-6,10H,2H2,1H3 |
| InChIKey | YXOGDBMOFMQLEU-UHFFFAOYSA-N |
| Mol Weight | 150.18 g/mol |
| Molecular Formula | C9H10O2 |
| Exact Mass | 150.06808 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | KfHM5xJpl8n |
|---|---|
| Name | 3'-Hydroxypropiophenone |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 150.068079560 u |
| Formula | C9H10O2 |
| InChI | InChI=1S/C9H10O2/c1-2-9(11)7-4-3-5-8(10)6-7/h3-6,10H,2H2,1H3 |
| InChIKey | YXOGDBMOFMQLEU-UHFFFAOYSA-N |
| Molecular Weight | 150.177 g/mol |
| SMILES | OC=1C=C(C=CC1)C(CC)=O |
| Spectrum/Structure Validation Score (Raman) | 0.972791 |