SpectraBase Spectrum ID |
LnknhK8GNHM |
Name |
Carbonic acid, monoamide, N-undecyl-, (1S)-(+)-menthyl ester |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
353.329379627 u |
Formula |
C22H43NO2 |
InChI |
InChI=1S/C22H43NO2/c1-5-6-7-8-9-10-11-12-13-16-23-22(24)25-21-17-19(4)14-15-20(21)18(2)3/h18-21H,5-17H2,1-4H3,(H,23,24) |
InChIKey |
KEKDWGZDABPXFV-UHFFFAOYSA-N |
Molecular Weight |
353.591 g/mol |
SMILES |
C(CCNC(OC1C(C(C)C)CCC(C)C1)=O)CCCCCCCC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.913551 |