| SpectraBase Spectrum ID |
A3S2dY77QNF |
| Name |
4-Cyclopentene-1,3-dione, 2-(4-methoxyphenyl)-2-methyl-4-(1-methyl-2,5-dioxo-3-cyclopenten-1-yl)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
324.099773610 u |
| Formula |
C19H16O5 |
| InChI |
InChI=1S/C19H16O5/c1-18(11-4-6-12(24-3)7-5-11)16(22)10-13(17(18)23)19(2)14(20)8-9-15(19)21/h4-10H,1-3H3 |
| InChIKey |
GUAWOHYOIYZJMM-UHFFFAOYSA-N |
| Molecular Weight |
324.332 g/mol |
| SMILES |
C=1(C(C(C=2C=CC(=CC2)OC)(C)C(C1)=O)=O)C1(C(C=CC1=O)=O)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.815825 |
