SpectraBase Compound ID | 2yoTZOLyYgF |
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InChI | InChI=1S/C15H20O4S/c1-11(2)10-18-14(16)8-9-15(17)19-12-6-4-5-7-13(12)20-3/h4-7,11H,8-10H2,1-3H3 |
InChIKey | OYDIOPILQXPWTK-UHFFFAOYSA-N |
Mol Weight | 296.38 g/mol |
Molecular Formula | C15H20O4S |
Exact Mass | 296.10823 g/mol |
SpectraBase Spectrum ID | GS6aefcR3kX |
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Name | Succinic acid, isobutyl 2-methylthiophenyl ester |
Comments | Computed using HOSE algorithm |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 296.108230294 u |
Formula | C15H20O4S |
InChI | InChI=1S/C15H20O4S/c1-11(2)10-18-14(16)8-9-15(17)19-12-6-4-5-7-13(12)20-3/h4-7,11H,8-10H2,1-3H3 |
InChIKey | OYDIOPILQXPWTK-UHFFFAOYSA-N |
Molecular Weight | 296.381 g/mol |
SMILES | C(OC1=CC=CC=C1SC)(=O)CCC(OCC(C)C)=O |