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2-(1-Cyclobutenyl)thioanisole
SpectraBase Compound ID IgY5IF8mPc2
InChI InChI=1S/C11H12S/c1-12-11-8-3-2-7-10(11)9-5-4-6-9/h2-3,5,7-8H,4,6H2,1H3
InChIKey KNQYUFYDNJCHRY-UHFFFAOYSA-N
Mol Weight 176.28 g/mol
Molecular Formula C11H12S
Exact Mass 176.065972 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IyI7h78FMXS
Name 2-(1-Cyclobutenyl)thioanisole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H12S
InChI InChI=1S/C11H12S/c1-12-11-8-3-2-7-10(11)9-5-4-6-9/h2-3,5,7-8H,4,6H2,1H3
InChIKey KNQYUFYDNJCHRY-UHFFFAOYSA-N
Molecular Weight 176.277 g/mol
SMILES C1(c2c(SC)cccc2)=CCC1
SPLASH splash10-03fr-0900000000-e6c1bea0862fb9f09013
Source of Spectrum F-56-4250-5
Synonyms 1-(1-cyclobuten-1-yl)-2-(methylsulfanyl)benzene 2-(1-cyclobuten-1-yl)phenyl methyl sulfide
Wiley ID 857554