| SpectraBase Spectrum ID |
CrROWrHASyn |
| Name |
2-Hydroxy-5-dibenzosuberone, acetate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
266.094294308 u |
| Formula |
C17H14O3 |
| InChI |
InChI=1S/C17H14O3/c1-11(18)20-14-8-9-16-13(10-14)7-6-12-4-2-3-5-15(12)17(16)19/h2-5,8-10H,6-7H2,1H3 |
| InChIKey |
MBVOIJFHMXLORY-UHFFFAOYSA-N |
| Molecular Weight |
266.296 g/mol |
| SMILES |
C1(OC(C)=O)=CC2=C(C=C1)C(=O)C1=C(CC2)C=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.87942 |
