| SpectraBase Spectrum ID |
2pNqIDusuYW |
| Name |
Cyclohexanecarboxamide, 4-methoxy-N-(2-pentyl)-N-tetradecyl-, trans |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
423.407629949 u |
| Formula |
C27H53NO2 |
| InChI |
InChI=1S/C27H53NO2/c1-5-7-8-9-10-11-12-13-14-15-16-17-23-28(24(3)18-6-2)27(29)25-19-21-26(30-4)22-20-25/h24-26H,5-23H2,1-4H3/t24?,25-,26- |
| InChIKey |
KFQSINXAAADXMC-FJUZFHEGSA-N |
| Molecular Weight |
423.726 g/mol |
| SMILES |
CCCC(N(C(=O)[C@]1(CC[C@](OC)(CC1)[H])[H])CCCCCCCCCCCCCC)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.896203 |
