SpectraBase Spectrum ID |
Ljj0aavAOY8 |
Name |
Carbonic acid, monoamide, N-(2-pentyl)-N-butyl-, methyl ester |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
201.172878983 u |
Formula |
C11H23NO2 |
InChI |
InChI=1S/C11H23NO2/c1-5-7-9-12(11(13)14-4)10(3)8-6-2/h10H,5-9H2,1-4H3 |
InChIKey |
NTOBPVRCPXSOPF-UHFFFAOYSA-N |
Molecular Weight |
201.310 g/mol |
SMILES |
CCCC(C)N(C(OC)=O)CCCC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.979189 |