SpectraBase Spectrum ID |
K0WcH8Nfmk4 |
Name |
Carbamic acid, N-(2-butyl)-N-dodecyl-, isobutyl ester |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
341.329379627 u |
Formula |
C21H43NO2 |
InChI |
InChI=1S/C21H43NO2/c1-6-8-9-10-11-12-13-14-15-16-17-22(20(5)7-2)21(23)24-18-19(3)4/h19-20H,6-18H2,1-5H3 |
InChIKey |
HTVQYBOIPKRIJM-UHFFFAOYSA-N |
Molecular Weight |
341.580 g/mol |
SMILES |
C(N(CCCCCCCCCCCC)C(CC)C)(=O)OCC(C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.83177 |