| SpectraBase Spectrum ID |
IzrYydqZuL3 |
| Name |
15-Methyl-hexadecanoic acid, dmox derivative |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
323.318814943 u |
| Formula |
C21H41NO |
| InChI |
InChI=1S/C21H41NO/c1-19(2)16-14-12-10-8-6-5-7-9-11-13-15-17-20-22-21(3,4)18-23-20/h19H,5-18H2,1-4H3 |
| InChIKey |
PLDMLGXLZCGJGJ-UHFFFAOYSA-N |
| Molecular Weight |
323.565 g/mol |
| SMILES |
C1(=NC(C)(C)CO1)CCCCCCCCCCCCCC(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.826083 |
