| SpectraBase Spectrum ID |
DxuaWCrFSgC |
| Name |
2-Butylamine, N-octadecyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
325.370850517 u |
| Formula |
C22H47N |
| InChI |
InChI=1S/C22H47N/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-23-22(3)5-2/h22-23H,4-21H2,1-3H3 |
| InChIKey |
CKAKAAWHXLQDNI-UHFFFAOYSA-N |
| Molecular Weight |
325.625 g/mol |
| SMILES |
C(CCNC(CC)C)CCCCCCCCCCCCCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.924008 |
