| SpectraBase Spectrum ID |
80g8w2gXcOF |
| Name |
2H-1-Benzopyran-2-one, 5,7-dimethoxy-4-(4-morpholinyl)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
291.110672646 u |
| Formula |
C15H17NO5 |
| InChI |
InChI=1S/C15H17NO5/c1-18-10-7-12(19-2)15-11(16-3-5-20-6-4-16)9-14(17)21-13(15)8-10/h7-9H,3-6H2,1-2H3 |
| InChIKey |
JAGCLPDJTOUDBC-UHFFFAOYSA-N |
| SMILES |
C=1C(=CC2=C(C1OC)C(=CC(O2)=O)N1CCOCC1)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.876498 |