SpectraBase Spectrum ID |
3qT0ygSeMad |
Name |
2-Undecanol dodecanoate |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
354.349780719 u |
Formula |
C23H46O2 |
InChI |
InChI=1S/C23H46O2/c1-4-6-8-10-12-13-15-17-19-21-23(24)25-22(3)20-18-16-14-11-9-7-5-2/h22H,4-21H2,1-3H3 |
InChIKey |
KNACTUIZSMVBLI-UHFFFAOYSA-N |
Molecular Weight |
354.619 g/mol |
SMILES |
CC(CCCCCCCCC)OC(=O)CCCCCCCCCCC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.888552 |