| SpectraBase Compound ID | KogmcHCBeD6 |
|---|---|
| InChI | InChI=1S/C6H9ClO2/c1-4(2)5(7)6(8)9-3/h5H,1H2,2-3H3 |
| InChIKey | FZUVHZZZCYKCFI-UHFFFAOYSA-N |
| Mol Weight | 148.59 g/mol |
| Molecular Formula | C6H9ClO2 |
| Exact Mass | 148.029107 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | J3OUVU3p3LE |
|---|---|
| Name | Methyl 2-chloro-3-methyl-3-butenoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 148.029107228 u |
| Formula | C6H9ClO2 |
| InChI | InChI=1S/C6H9ClO2/c1-4(2)5(7)6(8)9-3/h5H,1H2,2-3H3 |
| InChIKey | FZUVHZZZCYKCFI-UHFFFAOYSA-N |
| Molecular Weight | 148.589 g/mol |
| SMILES | C(C(C(=C)C)Cl)(=O)OC |