| SpectraBase Spectrum ID |
2CyJ0acau3c |
| Name |
2,3-di-(1-Acetylethen-1-yl)-1,4-naphthalenquinone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
294.089208927 u |
| Formula |
C18H14O4 |
| InChI |
InChI=1S/C18H14O4/c1-9(11(3)19)15-16(10(2)12(4)20)18(22)14-8-6-5-7-13(14)17(15)21/h5-8H,1-2H2,3-4H3 |
| InChIKey |
BPJQCDIUMUUVRX-UHFFFAOYSA-N |
| Molecular Weight |
294.306 g/mol |
| SMILES |
C1(=C(C(=O)C2=C(C1=O)C=CC=C2)C(C(=O)C)=C)C(C(=O)C)=C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.97289 |
