| SpectraBase Spectrum ID |
4pXKx9h5l3h |
| Name |
2-Hydroxy-5,7-dimethoxy-3-(3,4-methylenedioxyphenyl)-4-chromanone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
344.089602848 u |
| Formula |
C18H16O7 |
| InChI |
InChI=1S/C18H16O7/c1-21-10-6-13(22-2)16-14(7-10)25-18(20)15(17(16)19)9-3-4-11-12(5-9)24-8-23-11/h3-7,15,18,20H,8H2,1-2H3 |
| InChIKey |
GKFCXODGYHHMAJ-UHFFFAOYSA-N |
| Molecular Weight |
344.319 g/mol |
| SMILES |
C12=C(OC(C(C2=O)C2=CC3=C(C=C2)OCO3)O)C=C(C=C1OC)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.932588 |
