SpectraBase Compound ID | EFyRuNtdilS |
---|---|
InChI | InChI=1S/C10H18O2/c1-9(2)7-5-3-4-6-8-10(11)12/h5,7,9H,3-4,6,8H2,1-2H3,(H,11,12)/b7-5- |
InChIKey | OCALSPDXYQHUHA-ALCCZGGFSA-N |
Mol Weight | 170.25 g/mol |
Molecular Formula | C10H18O2 |
Exact Mass | 170.13068 g/mol |
SpectraBase Spectrum ID | Hd71U2lSBE8 |
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Name | (Z)-8-Methyl-6-nonenoic acid |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 170.130679818 u |
Formula | C10H18O2 |
InChI | InChI=1S/C10H18O2/c1-9(2)7-5-3-4-6-8-10(11)12/h5,7,9H,3-4,6,8H2,1-2H3,(H,11,12)/b7-5- |
InChIKey | OCALSPDXYQHUHA-ALCCZGGFSA-N |
Molecular Weight | 170.252 g/mol |
SMILES | C(=O)(O)CCCC\C=C/C(C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.955769 |