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3,8,9-TRIMETHOXY-5-H-DIBENZO-[A,C]-CYClOHEPTENE-2,10-DIOL
SpectraBase Compound ID F9vq0a5vOQH
InChI InChI=1S/C18H18O5/c1-21-16-7-10-5-4-6-11-13(12(10)8-14(16)19)9-15(20)18(23-3)17(11)22-2/h4,6-9,19-20H,5H2,1-3H3
InChIKey JNKXHKCNCXJVML-UHFFFAOYSA-N
Mol Weight 314.34 g/mol
Molecular Formula C18H18O5
Exact Mass 314.115424 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FZQoRm2kGbC
Name 3,8,9-TRIMETHOXY-5-H-DIBENZO-[A,C]-CYClOHEPTENE-2,10-DIOL
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H18O5
InChI InChI=1S/C18H18O5/c1-21-16-7-10-5-4-6-11-13(12(10)8-14(16)19)9-15(20)18(23-3)17(11)22-2/h4,6-9,19-20H,5H2,1-3H3
InChIKey JNKXHKCNCXJVML-UHFFFAOYSA-N
Literature Reference Author S.KANOKMEDHAKUL,K.KANOKMEDHAKUL,K.NAMBUDDEE,P.KONGSAEREE
Literature Reference Citation J.NAT.PROD.,67,968(2004)
Literature Reference DOI 10.1021/np030519j
Molecular Weight 314.338 g/mol
Solvent CDL3
Source File Reference UWMZ7269