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2-Thiono-8-methoxy-psoralen

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2-Thiono-8-methoxy-psoralen
SpectraBase Compound ID 9wKD3zpdA1r
InChI InChI=1S/C12H8O3S/c1-13-12-10-8(4-5-14-10)6-7-2-3-9(16)15-11(7)12/h2-6H,1H3
InChIKey PAGXNNWUSDPOFA-UHFFFAOYSA-N
Mol Weight 232.25 g/mol
Molecular Formula C12H8O3S
Exact Mass 232.019415 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8jFqBZ5yUDG
Name 2-THIONO-8-METHOXYPSORALEN
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H8O3S
InChI InChI=1S/C12H8O3S/c1-13-12-10-8(4-5-14-10)6-7-2-3-9(16)15-11(7)12/h2-6H,1H3
InChIKey PAGXNNWUSDPOFA-UHFFFAOYSA-N
Literature Reference Author H.DUDDECK,M.KAISER
Literature Reference Citation ORG.MAGN.RES.,20,55(1982)
Literature Reference DOI 10.1002/mrc.1270200202
Molecular Weight 232.254 g/mol
Solvent DMSO
Source File Reference UNIW5767