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TRICYCLOALTERNARENE_B
SpectraBase Compound ID 3GKAKIBDItM
InChI InChI=1S/C22H34O5/c1-13(2)7-6-9-21(3,25)15-8-10-22(4)16(15)11-14-19(24)18(26-5)12-17(23)20(14)27-22/h7,15-18,23,25H,6,8-12H2,1-5H3/t15-,16+,17+,18-,21?,22-/m1/s1
InChIKey PKJMKVUVJHKWBS-UDZHKBTQSA-N
Mol Weight 378.5 g/mol
Molecular Formula C22H34O5
Exact Mass 378.240624 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1ztS0y74KGh
Name TRICYCLOALTERNARENE_B
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H34O5
InChI InChI=1S/C22H34O5/c1-13(2)7-6-9-21(3,25)15-8-10-22(4)16(15)11-14-19(24)18(26-5)12-17(23)20(14)27-22/h7,15-18,23,25H,6,8-12H2,1-5H3/t15-,16+,17+,18-,21?,22-/m1/s1
InChIKey PKJMKVUVJHKWBS-UDZHKBTQSA-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 378.509 g/mol
Solvent CDCl3
Source File Reference UWMZ43357