SpectraBase Compound ID | CiYBWWJWaoA |
---|---|
InChI | InChI=1S/C14H17ClO5/c1-2-18-8-9-19-13(16)6-7-14(17)20-12-5-3-4-11(15)10-12/h3-5,10H,2,6-9H2,1H3 |
InChIKey | BJEYIGLVACCCBR-UHFFFAOYSA-N |
Mol Weight | 300.74 g/mol |
Molecular Formula | C14H17ClO5 |
Exact Mass | 300.076451 g/mol |
SpectraBase Spectrum ID | EdMul8bsnUS |
---|---|
Name | Succinic acid, 3-chlorophenyl 2-ethoxyethyl 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/c1-2-18-8-9-19-13(16)6-7-14(17)20-12-5-3-4-11(15)10-12/h3-5,10H,2,6-9H2,1H3 |
InChIKey | BJEYIGLVACCCBR-UHFFFAOYSA-N |
Molecular Weight | 300.738 g/mol |
SMILES | C(CC(OC1=CC(=CC=C1)Cl)=O)C(OCCOCC)=O |