SpectraBase Spectrum ID |
D5NdszvPqU7 |
Name |
Carbonic acid, monoamide, tert-butyl ester, N-heptyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
215.188529047 u |
Formula |
C12H25NO2 |
InChI |
InChI=1S/C12H25NO2/c1-5-6-7-8-9-10-13-11(14)15-12(2,3)4/h5-10H2,1-4H3,(H,13,14) |
InChIKey |
FZLPUYAYMMDNKU-UHFFFAOYSA-N |
Molecular Weight |
215.337 g/mol |
SMILES |
CC(C)(C)OC(=O)NCCCCCCC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.937122 |