| SpectraBase Spectrum ID |
5c0A1JDcqFE |
| Name |
Benzamide, N-allyl-N-(hept-2-yl)-3,4,5-trimethoxy- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
349.225308478 u |
| Formula |
C20H31NO4 |
| InChI |
InChI=1S/C20H31NO4/c1-7-9-10-11-15(3)21(12-8-2)20(22)16-13-17(23-4)19(25-6)18(14-16)24-5/h8,13-15H,2,7,9-12H2,1,3-6H3 |
| InChIKey |
WQRXSFXATOFVNV-UHFFFAOYSA-N |
| Molecular Weight |
349.471 g/mol |
| SMILES |
C(N(C(CCCCC)C)CC=C)(=O)C1=CC(=C(OC)C(OC)=C1)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.86732 |
