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3-(methylthio)-2-methoxy-1,4-benzoquinone
SpectraBase Compound ID Ct4OYPYcLoF
InChI InChI=1S/C8H8O3S/c1-11-7-5(9)3-4-6(10)8(7)12-2/h3-4H,1-2H3
InChIKey LATGYATZBMREFH-UHFFFAOYSA-N
Mol Weight 184.21 g/mol
Molecular Formula C8H8O3S
Exact Mass 184.019415 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1EiLfmHQtBd
Name 3-(methylthio)-2-methoxy-1,4-benzoquinone
CAS Registry Number 112520-80-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H8O3S
InChI InChI=1S/C8H8O3S/c1-11-7-5(9)3-4-6(10)8(7)12-2/h3-4H,1-2H3
InChIKey LATGYATZBMREFH-UHFFFAOYSA-N
Molecular Weight 184.209 g/mol
SMILES C1(=C(C(=O)C=CC1=O)OC)SC
SPLASH splash10-00li-1900000000-4e18d4aa955ec081161e
Source of Spectrum J-53-4271-7
Synonyms 2-Methoxy-3-(methylsulfanyl)benzo-1,4-quinone
Wiley ID 1180122