| SpectraBase Compound ID | GwyTWHYbXhZ |
|---|---|
| InChI | InChI=1S/C8H12O2/c1-2-3-4-5-6-7-8(9)10/h2-5H2,1H3,(H,9,10) |
| InChIKey | BQDKCWCMDBMLEH-UHFFFAOYSA-N |
| Mol Weight | 140.18 g/mol |
| Molecular Formula | C8H12O2 |
| Exact Mass | 140.08373 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | JOVioWrf455 |
|---|---|
| Name | OCT-2-YNOIC ACID |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C8H12O2 |
| InChI | InChI=1S/C8H12O2/c1-2-3-4-5-6-7-8(9)10/h2-5H2,1H3,(H,9,10) |
| InChIKey | BQDKCWCMDBMLEH-UHFFFAOYSA-N |
| Molecular Weight | 140.0834 |
| SMILES | OC(=O)C#CCCCCC |
| SPLASH | splash10-0036-9000000000-3bbdab558ce81689b00e |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |