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3-METHYLTHIO-10,11,12-TRIMETHOXY-7,8-DIHYDRO-4H-BENZO-[1,2]-HEPTALENO-[5,6-CD]-ISOXAZOL-4-ONE
SpectraBase Compound ID 1lunLH5ed7R
InChI InChI=1S/C20H19NO5S/c1-23-13-9-10-5-7-12-16-11(15(10)20(25-3)18(13)24-2)6-8-14(27-4)17(22)19(16)26-21-12/h6,8-9H,5,7H2,1-4H3
InChIKey DOLJBJJWABEUGX-UHFFFAOYSA-N
Mol Weight 385.43 g/mol
Molecular Formula C20H19NO5S
Exact Mass 385.098394 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2svC3IujxyC
Name 3-METHYLTHIO-10,11,12-TRIMETHOXY-7,8-DIHYDRO-4H-BENZO-[1,2]-HEPTALENO-[5,6-CD]-ISOXAZOL-4-ONE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H19NO5S
InChI InChI=1S/C20H19NO5S/c1-23-13-9-10-5-7-12-16-11(15(10)20(25-3)18(13)24-2)6-8-14(27-4)17(22)19(16)26-21-12/h6,8-9H,5,7H2,1-4H3
InChIKey DOLJBJJWABEUGX-UHFFFAOYSA-N
Literature Reference Author U.BERG,H.BLADH,M.HOFF,C.SVENSSON
Literature Reference Citation J.CHEM.SOC.PERKIN-2,1697(1997)
Literature Reference DOI 10.1039/a701400g
Molecular Weight 385.435 g/mol
Solvent Unknown