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4-(Hex-1-yn-1-yl)-5-(p-tolyl)-7H-thieno[2,3-c]pyran-7-one
SpectraBase Compound ID 6sgKndDiO4E
InChI InChI=1S/C20H18O2S/c1-3-4-5-6-7-16-17-12-13-23-19(17)20(21)22-18(16)15-10-8-14(2)9-11-15/h8-13H,3-5H2,1-2H3
InChIKey JJBNRTBQRWNROB-UHFFFAOYSA-N
Mol Weight 322.42 g/mol
Molecular Formula C20H18O2S
Exact Mass 322.102751 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JGfkZMcrA0x
Name 4-(Hex-1-yn-1-yl)-5-(p-tolyl)-7H-thieno[2,3-c]pyran-7-one
Appearance Yellow solid
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Formula C20H18O2S
InChI InChI=1S/C20H18O2S/c1-3-4-5-6-7-16-17-12-13-23-19(17)20(21)22-18(16)15-10-8-14(2)9-11-15/h8-13H,3-5H2,1-2H3
InChIKey JJBNRTBQRWNROB-UHFFFAOYSA-N
Instrument Name GC??MS apparatus
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.202000468
Molecular Weight 322.422 g/mol
Reported Formula C20H18O2S
SMILES C(#CCCCC)C=1c2c(C(OC1c1ccc(cc1)C)=O)scc2
SPLASH splash10-00yl-2294000000-09b5f14eddbc2b3988c0
Source of Spectrum U1-2020-3724-10
Wiley ID 1860722