| SpectraBase Spectrum ID |
7s2Fik5QCCR |
| Name |
1-Allyl-1,2-dihydro-2',5'-dimethoxy-2-oxonicotinanilide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
314.126657064 u |
| Formula |
C17H18N2O4 |
| InChI |
InChI=1S/C17H18N2O4/c1-4-9-19-10-5-6-13(17(19)21)16(20)18-14-11-12(22-2)7-8-15(14)23-3/h4-8,10-11H,1,9H2,2-3H3,(H,18,20) |
| InChIKey |
YWQWFGHFXIUNMB-UHFFFAOYSA-N |
| Molecular Weight |
314.341 g/mol |
| SMILES |
N(C(C1=CC=CN(C1=O)CC=C)=O)C1=C(OC)C=CC(=C1)OC |
| Spectrum/Structure Validation Score (Raman) |
0.907969 |
