| SpectraBase Spectrum ID |
DtsPOMyAgke |
| Name |
6-Cyclopropanecarbonyl-7-(2,3-dihydro-1,4-benzodioxin-6-yl)-2,3-dihydro-1,4-benzodioxine |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
338.115423675 u |
| Formula |
C20H18O5 |
| InChI |
InChI=1S/C20H18O5/c21-20(12-1-2-12)15-11-19-18(24-7-8-25-19)10-14(15)13-3-4-16-17(9-13)23-6-5-22-16/h3-4,9-12H,1-2,5-8H2 |
| InChIKey |
FXHYEXHUSTZUAG-UHFFFAOYSA-N |
| Molecular Weight |
338.359 g/mol |
| SMILES |
C1=C2C(OCCO2)=CC(=C1C1=CC=C2OCCOC2=C1)C(=O)C1CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.964766 |
