| SpectraBase Spectrum ID |
JDaeCOOSrEi |
| Name |
Cyclohexanecarboxamide, 4-methoxy-N-(2-pentyl)-N-(3-methylbutyl)-, trans |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
297.266779369 u |
| Formula |
C18H35NO2 |
| InChI |
InChI=1S/C18H35NO2/c1-6-7-15(4)19(13-12-14(2)3)18(20)16-8-10-17(21-5)11-9-16/h14-17H,6-13H2,1-5H3/t15?,16-,17- |
| InChIKey |
XEBDSVMDYSENAA-ATBAIXNZSA-N |
| SMILES |
CCCC(N(C(=O)[C@]1(CC[C@](OC)(CC1)[H])[H])CCC(C)C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.956949 |
