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(+/-)-4-ACETOXY-3,4-DIHYDRO-5-METHOXY-2,2-DIMETHYL-2H,6H-PYRAN-[3,2-B]-THIOXANTHEN-6-ONE
SpectraBase Compound ID AyNzhLZJHTm
InChI InChI=1S/C21H20O5S/c1-11(22)25-14-10-21(2,3)26-13-9-16-18(20(24-4)17(13)14)19(23)12-7-5-6-8-15(12)27-16/h5-9,14H,10H2,1-4H3
InChIKey FIBWCXWGOFYIBJ-UHFFFAOYSA-N
Mol Weight 384.45 g/mol
Molecular Formula C21H20O5S
Exact Mass 384.103145 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5hRNfx9ENfa
Name (+/-)-4-ACETOXY-3,4-DIHYDRO-5-METHOXY-2,2-DIMETHYL-2H,6H-PYRAN-[3,2-B]-THIOXANTHEN-6-ONE
Compound Number 14B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H20O5S
InChI InChI=1S/C21H20O5S/c1-11(22)25-14-10-21(2,3)26-13-9-16-18(20(24-4)17(13)14)19(23)12-7-5-6-8-15(12)27-16/h5-9,14H,10H2,1-4H3
InChIKey FIBWCXWGOFYIBJ-UHFFFAOYSA-N
Literature Reference Author I.K.KOSTAKIS,N.POULI,P.MARAKOS,E.MOKROS,A.L.SKALTSOUNIS,S.LE ONCE,G.ATASSI,P.RENA
Literature Reference Citation BIOORG.MED.CHEM.,9,2973(2001)
Molecular Weight 384.447 g/mol
Solvent CDCl3
Source File Reference UWMS22250