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3-(acetylthio)-hexanal
SpectraBase Compound ID GgBn2BZXSOq
InChI InChI=1S/C8H14O2S/c1-3-4-8(5-6-9)11-7(2)10/h6,8H,3-5H2,1-2H3
InChIKey OQUGQLWJRJXLOV-UHFFFAOYSA-N
Mol Weight 174.26 g/mol
Molecular Formula C8H14O2S
Exact Mass 174.071451 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AmxDliIbimV
Name 3-(acetylthio)-hexanal
Alternate Name(s) S-(1-oxohexan-3-yl) ethanethioate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H14O2S
InChI InChI=1S/C8H14O2S/c1-3-4-8(5-6-9)11-7(2)10/h6,8H,3-5H2,1-2H3
InChIKey OQUGQLWJRJXLOV-UHFFFAOYSA-N
Literature Reference DOI 10.1002/ffj.3246
Molecular Weight 174.258 g/mol
SMILES C(CC(CCC)SC(=O)C)=O
SPLASH splash10-0006-9200000000-3694679d4cebac2a67bb
Source of Spectrum FF-30-304-399
Wiley ID 1787430