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Psoralen

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Psoralen
SpectraBase Compound ID 7CGNGbHFxQJ
InChI InChI=1S/C22H12O6/c23-21-19-17(11-5-9-1-3-25-13(9)7-15(11)27-21)18-12-6-10-2-4-26-14(10)8-16(12)28-22(24)20(18)19/h1-8,17-20H/t17-,18+,19-,20+
InChIKey ZNCWXXJTDDGKHO-FGYAAKKASA-N
Mol Weight 372.33 g/mol
Molecular Formula C22H12O6
Exact Mass 372.063388 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KsqMJPgV6ED
Name PSORALEN
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H12O6
InChI InChI=1S/C22H12O6/c23-21-19-17(11-5-9-1-3-25-13(9)7-15(11)27-21)18-12-6-10-2-4-26-14(10)8-16(12)28-22(24)20(18)19/h1-8,17-20H/t17-,18+,19-,20+
InChIKey ZNCWXXJTDDGKHO-FGYAAKKASA-N
Literature Reference Author S.ROJAS-LIMA,R.L.SANTILLAN,M.A.DOMINGUEZ,A.GUTIERREZ
Literature Reference Citation PHYTOCHEM.,50,863(1999)
Literature Reference DOI 10.1016/S0031-9422(98)00520-2
Molecular Weight 372.334 g/mol
Solvent DMSO-D6
Source File Reference UWVN1472