| SpectraBase Compound ID | 2KOM1JpOOS9 |
|---|---|
| InChI | InChI=1S/C7H10O2/c1-3-4-5-6-7(8)9-2/h3,5-6H,1,4H2,2H3/b6-5+ |
| InChIKey | ODLGSRPFJDMGNW-AATRIKPKSA-N |
| Mol Weight | 126.15 g/mol |
| Molecular Formula | C7H10O2 |
| Exact Mass | 126.06808 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AzZuGWXNBea |
|---|---|
| Name | 2,5-HEXADIENOIC ACID, METHYL ESTER |
| Source of Sample | F. K. Sheffy, J. P. Godschalx, J. K. Stille J. Amer. Chem. Soc. 106, 4833 (1984) |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H10O2 |
| InChI | InChI=1S/C7H10O2/c1-3-4-5-6-7(8)9-2/h3,5-6H,1,4H2,2H3/b6-5+ |
| InChIKey | ODLGSRPFJDMGNW-AATRIKPKSA-N |
| Molecular Weight | 126.16 |
| Solvent | Chloroform-d; Reference=TMS; Temperature=Ambient Spectrometer= Jeol FX-100 |