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MONOCYCLOALTERNARENE_B
SpectraBase Compound ID LDWCvBq3V1P
InChI InChI=1S/C22H32O6/c1-14(6-5-7-15(2)9-11-19(24)22(3,4)28)8-10-16-12-17(21(26)27)13-18(23)20(16)25/h7-8,12-13,19,23-25,28H,5-6,9-11H2,1-4H3,(H,26,27)/b14-8+,15-7+/t19-/m1/s1
InChIKey HEKKNGJOTDHUHQ-IJEFQKSISA-N
Mol Weight 392.5 g/mol
Molecular Formula C22H32O6
Exact Mass 392.219889 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BqE3okr6OKQ
Name MONOCYCLOALTERNARENE_B
Compound Number 13
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H32O6
InChI InChI=1S/C22H32O6/c1-14(6-5-7-15(2)9-11-19(24)22(3,4)28)8-10-16-12-17(21(26)27)13-18(23)20(16)25/h7-8,12-13,19,23-25,28H,5-6,9-11H2,1-4H3,(H,26,27)/b14-8+,15-7+/t19-/m1/s1
InChIKey HEKKNGJOTDHUHQ-IJEFQKSISA-N
Literature Reference Author G.ZHANG,G.WU,T.ZHU,T.KURTAN,A.MANDI,J.JIAO,J.LI,X.QI,Q.GU,D. LI
Literature Reference Citation J.NAT.PROD.,76,1946(2013)
Literature Reference DOI 10.1021/np4005757
Molecular Weight 392.492 g/mol
Solvent DMSO-D6
Source File Reference UWMZ43360