| SpectraBase Compound ID | 1gB7l148bJP |
|---|---|
| InChI | InChI=1S/C12H16O2/c1-2-11(13)12(14)9-8-10-6-4-3-5-7-10/h3-7,12,14H,2,8-9H2,1H3 |
| InChIKey | QDWMOXKILOMHPP-UHFFFAOYSA-N |
| Mol Weight | 192.26 g/mol |
| Molecular Formula | C12H16O2 |
| Exact Mass | 192.11503 g/mol |
Vapor Phase (Gas) Infrared Spectrum
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 7QTfBrDIzEh |
|---|---|
| Name | 4-Hydroxy-6-phenyl-3-hexanone |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 192.115029753 u |
| Formula | C12H16O2 |
| InChI | InChI=1S/C12H16O2/c1-2-11(13)12(14)9-8-10-6-4-3-5-7-10/h3-7,12,14H,2,8-9H2,1H3 |
| InChIKey | QDWMOXKILOMHPP-UHFFFAOYSA-N |
| Molecular Weight | 192.258 g/mol |
| SMILES | C(=O)(C(CCC1=CC=CC=C1)O)CC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.901927 |