| SpectraBase Compound ID | CjbjWwraBMC |
|---|---|
| InChI | InChI=1S/C7H12O3/c8-6-4-2-1-3-5-7(9)10/h2,4,8H,1,3,5-6H2,(H,9,10)/b4-2- |
| InChIKey | ALOHNDIZHJDJFZ-RQOWECAXSA-N |
| Mol Weight | 144.17 g/mol |
| Molecular Formula | C7H12O3 |
| Exact Mass | 144.078644 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8nb9npPeiWX |
|---|---|
| Name | (Z)-7-Hydroxy-5-heptenoic acid |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 144.078644243 u |
| Formula | C7H12O3 |
| InChI | InChI=1S/C7H12O3/c8-6-4-2-1-3-5-7(9)10/h2,4,8H,1,3,5-6H2,(H,9,10)/b4-2- |
| InChIKey | ALOHNDIZHJDJFZ-RQOWECAXSA-N |
| SMILES | C(=O)(O)CCC\C=C/CO |