SpectraBase Spectrum ID |
3f8pPlmuCnj |
Name |
Z-8-Methyl-9-tetradecen-1-ol formate |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
254.224580204 u |
Formula |
C16H30O2 |
InChI |
InChI=1S/C16H30O2/c1-3-4-5-9-12-16(2)13-10-7-6-8-11-14-18-15-17/h9,12,15-16H,3-8,10-11,13-14H2,1-2H3/b12-9- |
InChIKey |
WXNBPJUVGWSQAL-XFXZXTDPSA-N |
Molecular Weight |
254.414 g/mol |
SMILES |
C(CCCCCCCOC=O)(\C=C/CCCC)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.860889 |