| SpectraBase Compound ID | HKSSK3In3jy |
|---|---|
| InChI | InChI=1S/C7H12O2/c1-2-3-4-5-6-7(8)9/h5-6H,2-4H2,1H3,(H,8,9) |
| InChIKey | YURNCBVQZBJDAJ-UHFFFAOYSA-N |
| Mol Weight | 128.17 g/mol |
| Molecular Formula | C7H12O2 |
| Exact Mass | 128.08373 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LsSs1aRGLc0 |
|---|---|
| Name | 2-HEPTENOIC ACID |
| Source of Sample | Research Organic/Inorganic Chemical Corporation, Belleville, New Jersey |
| Comments | Tentative assignment |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H12O2 |
| InChI | InChI=1S/C7H12O2/c1-2-3-4-5-6-7(8)9/h5-6H,2-4H2,1H3,(H,8,9) |
| InChIKey | YURNCBVQZBJDAJ-UHFFFAOYSA-N |
| Molecular Weight | 128.17 |
| Solvent | Chloroform-d; Reference=TMS Spectrometer= Varian HA-100/Digilab FT-NMR-3 |