SpectraBase Compound ID | 8EHQsyEkIj9 |
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InChI | InChI=1S/C11H22O3/c1-2-3-7-10(12)8-5-4-6-9-11(13)14/h10,12H,2-9H2,1H3,(H,13,14) |
InChIKey | SGBOORBSRBYGEW-UHFFFAOYSA-N |
Mol Weight | 202.29 g/mol |
Molecular Formula | C11H22O3 |
Exact Mass | 202.156895 g/mol |
SpectraBase Spectrum ID | Ly10Jjo9Z4D |
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Name | 7-Hydroxyundecanoic acid |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 202.156894565 u |
Formula | C11H22O3 |
InChI | InChI=1S/C11H22O3/c1-2-3-7-10(12)8-5-4-6-9-11(13)14/h10,12H,2-9H2,1H3,(H,13,14) |
InChIKey | SGBOORBSRBYGEW-UHFFFAOYSA-N |
Molecular Weight | 202.294 g/mol |
SMILES | C(=O)(O)CCCCCC(O)CCCC |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.871501 |