SpectraBase Compound ID | 3Qee9F3XuKh |
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InChI | InChI=1S/C8H12O3/c1-2-3-4-5-7(9)6-8(10)11/h7,9H,4-6H2,1H3,(H,10,11) |
InChIKey | QJMSELGYZLXRSQ-UHFFFAOYSA-N |
Mol Weight | 156.18 g/mol |
Molecular Formula | C8H12O3 |
Exact Mass | 156.078644 g/mol |
SpectraBase Spectrum ID | 2zyDMa56t56 |
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Name | 3-Hydroxy-6-octynoic acid |
Comments | Less than 3 mono-isotopic peaks |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C8H12O3 |
InChI | InChI=1S/C8H12O3/c1-2-3-4-5-7(9)6-8(10)11/h7,9H,4-6H2,1H3,(H,10,11) |
InChIKey | QJMSELGYZLXRSQ-UHFFFAOYSA-N |
Molecular Weight | 156.181 g/mol |
SMILES | OC(CC(CCC#CC)O)=O |
SPLASH | splash10-0006-9200000000-6e5abd2b494a39141754 |
Source of Spectrum | H1-40-704-16 |
Wiley ID | 756849 |