SpectraBase Spectrum ID |
IoXqhOOA45m |
Name |
Myristamide, N-(hept-2-yl)- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
325.334465008 u |
Formula |
C21H43NO |
InChI |
InChI=1S/C21H43NO/c1-4-6-8-9-10-11-12-13-14-15-17-19-21(23)22-20(3)18-16-7-5-2/h20H,4-19H2,1-3H3,(H,22,23) |
InChIKey |
JCEXHIAXQGOPJE-UHFFFAOYSA-N |
Molecular Weight |
325.581 g/mol |
SMILES |
C(NC(CCCCC)C)(=O)CCCCCCCCCCCCC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.912569 |