| SpectraBase Compound ID | 7iSK3sTBtGM |
|---|---|
| InChI | InChI=1S/C14H18Cl2O3/c1-10(2)9-19-14(17)4-3-7-18-13-6-5-11(15)8-12(13)16/h5-6,8,10H,3-4,7,9H2,1-2H3 |
| InChIKey | ASZGOMRWZJMION-UHFFFAOYSA-N |
| Mol Weight | 305.2 g/mol |
| Molecular Formula | C14H18Cl2O3 |
| Exact Mass | 304.0633 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LRHYZONStnM |
|---|---|
| Name | Butanoic acid, 4-(2,4-dichlorophenoxy)-, 2-methylpropyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 304.063299837 u |
| Formula | C14H18Cl2O3 |
| InChI | InChI=1S/C14H18Cl2O3/c1-10(2)9-19-14(17)4-3-7-18-13-6-5-11(15)8-12(13)16/h5-6,8,10H,3-4,7,9H2,1-2H3 |
| InChIKey | ASZGOMRWZJMION-UHFFFAOYSA-N |
| Molecular Weight | 305.201 g/mol |
| SMILES | C(OC1=C(Cl)C=C(C=C1)Cl)CCC(OCC(C)C)=O |