SpectraBase Compound ID | 5aHW6XmxOW4 |
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InChI | InChI=1S/C14H17ClO5/c1-10-9-11(3-4-12(10)15)20-14(17)6-5-13(16)19-8-7-18-2/h3-4,9H,5-8H2,1-2H3 |
InChIKey | LUIYSIVAAJZJNG-UHFFFAOYSA-N |
Mol Weight | 300.74 g/mol |
Molecular Formula | C14H17ClO5 |
Exact Mass | 300.076451 g/mol |
SpectraBase Spectrum ID | G0qWDgRyY9T |
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Name | Succinic acid, 4-chloro-3-methylphenyl 2-methoxyethyl ester |
Comments | Computed using HOSE algorithm |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 300.076451342 u |
Formula | C14H17ClO5 |
InChI | InChI=1S/C14H17ClO5/c1-10-9-11(3-4-12(10)15)20-14(17)6-5-13(16)19-8-7-18-2/h3-4,9H,5-8H2,1-2H3 |
InChIKey | LUIYSIVAAJZJNG-UHFFFAOYSA-N |
Molecular Weight | 300.738 g/mol |
SMILES | C(CC(OC1=CC(C)=C(C=C1)Cl)=O)C(OCCOC)=O |