| SpectraBase Spectrum ID |
65fcjAAJEHO |
| Name |
N-Homoveratryl-2-(homoveratrylamino)acetamide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
402.215472069 u |
| Formula |
C22H30N2O5 |
| InChI |
InChI=1S/C22H30N2O5/c1-26-18-7-5-16(13-20(18)28-3)9-11-23-15-22(25)24-12-10-17-6-8-19(27-2)21(14-17)29-4/h5-8,13-14,23H,9-12,15H2,1-4H3,(H,24,25) |
| InChIKey |
LFVGKPQQNHRQRV-UHFFFAOYSA-N |
| Molecular Weight |
402.491 g/mol |
| SMILES |
C=1(C(=CC=C(C1)CCNCC(=O)NCCC=1C=C(OC)C(=CC1)OC)OC)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.907902 |
