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PINNATAL
SpectraBase Compound ID OcMIA6tTkA
InChI InChI=1S/C20H18O5/c1-18(9-21)13-5-6-19(2)14(13)8-15-16(23)11-4-3-10(22)7-12(11)17(24)20(15,18)25-19/h3-4,7-9,13-14,22H,5-6H2,1-2H3/t13-,14-,18-,19+,20-/m0/s1
InChIKey XMDCRBHPCMHPQU-YJKZWKBDSA-N
Mol Weight 338.36 g/mol
Molecular Formula C20H18O5
Exact Mass 338.115424 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HAjKnp92V2c
Name PINNATAL
CAS Registry Number 85051-40-7
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H18O5
InChI InChI=1S/C20H18O5/c1-18(9-21)13-5-6-19(2)14(13)8-15-16(23)11-4-3-10(22)7-12(11)17(24)20(15,18)25-19/h3-4,7-9,13-14,22H,5-6H2,1-2H3/t13-,14-,18-,19+,20-/m0/s1
InChIKey XMDCRBHPCMHPQU-YJKZWKBDSA-N
Literature Reference Author B.ONEGI,C.KRAFT,I.KOEHLER,M.FREUND,K.JENETT-SIEMS,K.SIEMS,G. BEYER,M.F.MELZIG,U.B
Literature Reference Citation PHYTOCHEM.,60,39(2002)
Literature Reference DOI 10.1016/S0031-9422(02)00072-9
Molecular Weight 338.360 g/mol
Solvent ACETONE-D6