| SpectraBase Spectrum ID |
L0E8laLxE6m |
| Name |
Benzamide, 3,4-dimethoxy-N-(2-phenylethyl)-N-undecyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
439.308644181 u |
| Formula |
C28H41NO3 |
| InChI |
InChI=1S/C28H41NO3/c1-4-5-6-7-8-9-10-11-15-21-29(22-20-24-16-13-12-14-17-24)28(30)25-18-19-26(31-2)27(23-25)32-3/h12-14,16-19,23H,4-11,15,20-22H2,1-3H3 |
| InChIKey |
YULRDCVNIMMPPV-UHFFFAOYSA-N |
| Molecular Weight |
439.640 g/mol |
| SMILES |
C1=CC=CC(=C1)CCN(C(=O)C=1C=CC(OC)=C(C1)OC)CCCCCCCCCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.937035 |
