SpectraBase Spectrum ID |
G94XQAjtxGj |
Name |
Methyl 8-hydroxy-5-methyl-4-decenoate |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
214.156894565 u |
Formula |
C12H22O3 |
InChI |
InChI=1S/C12H22O3/c1-4-11(13)9-8-10(2)6-5-7-12(14)15-3/h6,11,13H,4-5,7-9H2,1-3H3/b10-6+ |
InChIKey |
PAFTXKVWUFSNKO-UXBLZVDNSA-N |
Molecular Weight |
214.305 g/mol |
SMILES |
C(CC\C=C\(CCC(CC)O)C)(=O)OC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.950272 |