SpectraBase Spectrum ID |
DENszPxt1tq |
Name |
Carbonic acid, monoamide, N-3-methylbutyl-, menthyl ester |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
269.235479240 u |
Formula |
C16H31NO2 |
InChI |
InChI=1S/C16H31NO2/c1-11(2)8-9-17-16(18)19-15-10-13(5)6-7-14(15)12(3)4/h11-15H,6-10H2,1-5H3,(H,17,18) |
InChIKey |
SCCXAJFKABEXQB-UHFFFAOYSA-N |
SMILES |
CC1CC(OC(=O)NCCC(C)C)C(C(C)C)CC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.976833 |