SpectraBase Compound ID | CYwElTZLZd7 |
---|---|
InChI | InChI=1S/C17H25ClO2/c18-14-8-3-1-2-4-9-15-20-17(19)13-12-16-10-6-5-7-11-16/h5-7,10-11H,1-4,8-9,12-15H2 |
InChIKey | MZSRWNOOTLGPIZ-UHFFFAOYSA-N |
Mol Weight | 296.84 g/mol |
Molecular Formula | C17H25ClO2 |
Exact Mass | 296.154308 g/mol |
SpectraBase Spectrum ID | 2pMANIJhQpJ |
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Name | 3-Phenylpropionic acid, 8-chlorooctyl ester |
Comments | Computed using HOSE algorithm |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 296.154307743 u |
Formula | C17H25ClO2 |
InChI | InChI=1S/C17H25ClO2/c18-14-8-3-1-2-4-9-15-20-17(19)13-12-16-10-6-5-7-11-16/h5-7,10-11H,1-4,8-9,12-15H2 |
InChIKey | MZSRWNOOTLGPIZ-UHFFFAOYSA-N |
SMILES | C1(=CC=CC=C1)CCC(=O)OCCCCCCCCCl |