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S-(2-Methylpropyl) 4-oxopentanethioate
SpectraBase Compound ID 8tyAnqUkoOc
InChI InChI=1S/C9H16O2S/c1-7(2)6-12-9(11)5-4-8(3)10/h7H,4-6H2,1-3H3
InChIKey SFRBKCQGXRINQB-UHFFFAOYSA-N
Mol Weight 188.28 g/mol
Molecular Formula C9H16O2S
Exact Mass 188.087101 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DDEw3juRljg
Name S-(2-Methylpropyl) 4-oxopentanethioate
Alternate Name(s) S-isobutyl 4-oxopentanethioate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H16O2S
InChI InChI=1S/C9H16O2S/c1-7(2)6-12-9(11)5-4-8(3)10/h7H,4-6H2,1-3H3
InChIKey SFRBKCQGXRINQB-UHFFFAOYSA-N
Molecular Weight 188.285 g/mol
SMILES C(CCC(C)=O)(=O)SCC(C)C
SPLASH splash10-0002-9000000000-e7dce820d9b3cba8554d
Source of Spectrum F-53-1339-23
Wiley ID 800098