| SpectraBase Spectrum ID |
3e79VIpfx4b |
| Name |
1,4,9,10-Tetrahydro-2,3-dimethyl-6-formyl-9,10-(o-benzeno)anthracene-1,4-dione |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
340.109944372 u |
| Formula |
C23H16O3 |
| InChI |
InChI=1S/C23H16O3/c1-11-12(2)23(26)21-19-15-6-4-3-5-14(15)18(20(21)22(11)25)16-8-7-13(10-24)9-17(16)19/h3-10,18-19H,1-2H3 |
| InChIKey |
WPOSNWJCZGQZQY-UHFFFAOYSA-N |
| Molecular Weight |
340.378 g/mol |
| SMILES |
C12=C(C(=O)C(=C(C2=O)C)C)C2C=3C(C1C1=C2C=CC(=C1)C=O)=CC=CC3 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.931815 |
