SpectraBase Spectrum ID |
IJ3S5ozmbpu |
Name |
Carbamic acid, N-methyl-N-butyl-, 2-ethylhexyl ester |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
243.219829176 u |
Formula |
C14H29NO2 |
InChI |
InChI=1S/C14H29NO2/c1-5-8-10-13(7-3)12-17-14(16)15(4)11-9-6-2/h13H,5-12H2,1-4H3 |
InChIKey |
ZZFJVKJQJWQDSW-UHFFFAOYSA-N |
Molecular Weight |
243.391 g/mol |
SMILES |
C(CN(C(OCC(CCCC)CC)=O)C)CC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.968579 |