| SpectraBase Spectrum ID |
3AiEfqHEpcr |
| Name |
2-Ethenyl-2-hydroxy-6,7-(methylenedioxy)indan-1-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
218.057908798 u |
| Formula |
C12H10O4 |
| InChI |
InChI=1S/C12H10O4/c1-2-12(14)5-7-3-4-8-10(16-6-15-8)9(7)11(12)13/h2-4,14H,1,5-6H2 |
| InChIKey |
QMDDGSDYNJVKNY-UHFFFAOYSA-N |
| Molecular Weight |
218.208 g/mol |
| SMILES |
C1=2C(C(C=C)(O)CC2C=CC2=C1OCO2)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.919676 |
