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2(3H)-Furanone, dihydro-5-[[(4-methylphenyl)thio]methyl]-
SpectraBase Compound ID B7dOZ6nf30p
InChI InChI=1S/C12H14O2S/c1-9-2-5-11(6-3-9)15-8-10-4-7-12(13)14-10/h2-3,5-6,10H,4,7-8H2,1H3
InChIKey AUXGWDVTBDJLCQ-UHFFFAOYSA-N
Mol Weight 222.3 g/mol
Molecular Formula C12H14O2S
Exact Mass 222.071451 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DiOz9yaF4gG
Name 2(3H)-Furanone, dihydro-5-[[(4-methylphenyl)thio]methyl]-
CAS Registry Number 108078-65-5
Comments Less than 3 mono-isotopic peaks
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Formula C12H14O2S
InChI InChI=1S/C12H14O2S/c1-9-2-5-11(6-3-9)15-8-10-4-7-12(13)14-10/h2-3,5-6,10H,4,7-8H2,1H3
InChIKey AUXGWDVTBDJLCQ-UHFFFAOYSA-N
Molecular Weight 222.302 g/mol
SMILES C1(OC(CSc2ccc(cc2)C)CC1)=O
SPLASH splash10-000i-0940000000-43d729854bc014a1ba5c
Source of Spectrum KC-1988-2530-66
Synonyms 5-p-tolylthiomethyl-4,5-dihydrofuran-2(3H)-one 5-{[(4-methylphenyl)sulfanyl]methyl}dihydro-2(3H)-furanone
Wiley ID 1222149