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2-(benzylthio)-3-methyl-1,4-naphthoquinone

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2-(benzylthio)-3-methyl-1,4-naphthoquinone
SpectraBase Compound ID HjwmXKGWUnx
InChI InChI=1S/C18H14O2S/c1-12-16(19)14-9-5-6-10-15(14)17(20)18(12)21-11-13-7-3-2-4-8-13/h2-10H,11H2,1H3
InChIKey DVPALWYMAIMQJF-UHFFFAOYSA-N
Mol Weight 294.37 g/mol
Molecular Formula C18H14O2S
Exact Mass 294.071451 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BlYJjCDgAdP
Name 2-(benzylthio)-3-methyl-1,4-naphthoquinone
Source of Sample Aldrich Chemical Company, Inc., Milwaukee, Wisconsin
Copyright Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H14O2S
InChI InChI=1S/C18H14O2S/c1-12-16(19)14-9-5-6-10-15(14)17(20)18(12)21-11-13-7-3-2-4-8-13/h2-10H,11H2,1H3
InChIKey DVPALWYMAIMQJF-UHFFFAOYSA-N
Instrument Name Varian A-60
Sadtler NMR Number 2376M
Solvent CDCl3
Synonyms 1,4-NAPHTHOQUINONE, 2-/BENZYLTHIO/- 3-METHYL-,