| SpectraBase Spectrum ID |
3JJVYleBA4u |
| Name |
2-Hydroxy-3-(3-oxo-3-phenylpropyl)-1,4-naphthalenedione |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
306.089208927 u |
| Formula |
C19H14O4 |
| InChI |
InChI=1S/C19H14O4/c20-16(12-6-2-1-3-7-12)11-10-15-17(21)13-8-4-5-9-14(13)18(22)19(15)23/h1-9,23H,10-11H2 |
| InChIKey |
WIUQKOHOTLRZDA-UHFFFAOYSA-N |
| Molecular Weight |
306.317 g/mol |
| SMILES |
C1(=C(C(=O)C2=C(C1=O)C=CC=C2)O)CCC(=O)C=1C=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.955874 |
