SpectraBase Compound ID | AsZ7eQGr3oy |
---|---|
InChI | InChI=1S/C14H26O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14(15)16/h3-4H,2,5-13H2,1H3,(H,15,16)/b4-3+ |
InChIKey | FWWOMPFHMRPXIH-ONEGZZNKSA-N |
Mol Weight | 226.36 g/mol |
Molecular Formula | C14H26O2 |
Exact Mass | 226.19328 g/mol |
SpectraBase Spectrum ID | 5EOZzGM8hZh |
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Name | E-11-Tetradecenoic acid |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 226.193280075 u |
Formula | C14H26O2 |
InChI | InChI=1S/C14H26O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14(15)16/h3-4H,2,5-13H2,1H3,(H,15,16)/b4-3+ |
InChIKey | FWWOMPFHMRPXIH-ONEGZZNKSA-N |
Molecular Weight | 226.360 g/mol |
SMILES | CC\C=C\CCCCCCCCCC(=O)O |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.975067 |