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4-Oxopentyl thioacetate
SpectraBase Compound ID JfA3ZbDNnRh
InChI InChI=1S/C7H12O2S/c1-6(8)4-3-5-10-7(2)9/h3-5H2,1-2H3
InChIKey GRHUKOJWGQVQPB-UHFFFAOYSA-N
Mol Weight 160.23 g/mol
Molecular Formula C7H12O2S
Exact Mass 160.055801 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LDLJxdIcgzQ
Name 4-Oxopentyl thioacetate
Alternate Name(s) S-(4-oxopentyl) ethanethioate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H12O2S
InChI InChI=1S/C7H12O2S/c1-6(8)4-3-5-10-7(2)9/h3-5H2,1-2H3
InChIKey GRHUKOJWGQVQPB-UHFFFAOYSA-N
Literature Reference DOI 10.1002/cbic.201800799
Molecular Weight 160.231 g/mol
SMILES CC(=O)CCCSC(C)=O
SPLASH splash10-0udi-5900000000-16e94b77ba71f140c32f
Source of Spectrum CBC-20-SM4-4_1
Wiley ID 1819377