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5,6-Dihydro-9,10-methylenedioxy-7-(methylthio)benzo[a]anthracene
SpectraBase Compound ID 6wuSwW5qDFT
InChI InChI=1S/C20H16O2S/c1-23-20-15-7-6-12-4-2-3-5-14(12)17(15)8-13-9-18-19(10-16(13)20)22-11-21-18/h2-5,8-10H,6-7,11H2,1H3
InChIKey UUCLHVZWBXAVTC-UHFFFAOYSA-N
Mol Weight 320.41 g/mol
Molecular Formula C20H16O2S
Exact Mass 320.087101 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1P3o3qfVQ1M
Name 5,6-Dihydro-9,10-methylenedioxy-7-(methylthio)benzo[a]anthracene
Alternate Name(s) 5,6-dihydrobenzo[5,6]anthra[2,3-d][1,3]dioxol-7-yl methyl sulfide 7-(methylsulfanyl)-5,6-dihydrobenzo[5,6]anthra[2,3-d][1,3]dioxole
Comments Less than 3 mono-isotopic peaks
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Formula C20H16O2S
InChI InChI=1S/C20H16O2S/c1-23-20-15-7-6-12-4-2-3-5-14(12)17(15)8-13-9-18-19(10-16(13)20)22-11-21-18/h2-5,8-10H,6-7,11H2,1H3
InChIKey UUCLHVZWBXAVTC-UHFFFAOYSA-N
Molecular Weight 320.406 g/mol
SMILES c-12c(c(SC)c3c(c2)cc2c(OCO2)c3)CCc2c1cccc2
SPLASH splash10-00di-0049000000-a4f97b158ff38feb6e59
Source of Spectrum F-55-12850-19
Wiley ID 839567