| SpectraBase Spectrum ID |
LiMRfq1LEFN |
| Name |
7-Methoxy-4-(7-methoxy-2H-1,3-benzodioxol-5-yl)-3,4-dihydro-1H-quinolin-2-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
327.110672646 u |
| Formula |
C18H17NO5 |
| InChI |
InChI=1S/C18H17NO5/c1-21-11-3-4-12-13(8-17(20)19-14(12)7-11)10-5-15(22-2)18-16(6-10)23-9-24-18/h3-7,13H,8-9H2,1-2H3,(H,19,20) |
| InChIKey |
MLKFCGHZZQVKRG-UHFFFAOYSA-N |
| Molecular Weight |
327.336 g/mol |
| SMILES |
C1=2NC(=O)CC(C2C=CC(=C1)OC)C1=CC=2OCOC2C(OC)=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.960804 |
