| SpectraBase Spectrum ID |
6d7BCPZ8t7i |
| Name |
Benzamide, 3,4,5-trimethoxy-N-octyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
323.209658414 u |
| Formula |
C18H29NO4 |
| InChI |
InChI=1S/C18H29NO4/c1-5-6-7-8-9-10-11-19-18(20)14-12-15(21-2)17(23-4)16(13-14)22-3/h12-13H,5-11H2,1-4H3,(H,19,20) |
| InChIKey |
IYKKOCFTBQUTCH-UHFFFAOYSA-N |
| Molecular Weight |
323.433 g/mol |
| SMILES |
C(C1=CC(OC)=C(OC)C(=C1)OC)(=O)NCCCCCCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.885028 |
