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HOSTMANIENE;METHYL-4-HYDROXY-3-(2',3'-DIHYDROXY-3'-METHYLBUTYL)-BENZOATE
SpectraBase Compound ID L6EhHKUvXI4
InChI InChI=1S/C13H18O5/c1-13(2,17)11(15)7-9-6-8(12(16)18-3)4-5-10(9)14/h4-6,11,14-15,17H,7H2,1-3H3
InChIKey ABFHVQPVDSMGNR-UHFFFAOYSA-N
Mol Weight 254.28 g/mol
Molecular Formula C13H18O5
Exact Mass 254.115424 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID D2lAGcN6YXI
Name HOSTMANIENE;METHYL-4-HYDROXY-3-(2',3'-DIHYDROXY-3'-METHYLBUTYL)-BENZOATE
Compound Number 18
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H18O5
InChI InChI=1S/C13H18O5/c1-13(2,17)11(15)7-9-6-8(12(16)18-3)4-5-10(9)14/h4-6,11,14-15,17H,7H2,1-3H3
InChIKey ABFHVQPVDSMGNR-UHFFFAOYSA-N
Literature Reference Author J.H.G.LAGO,C.S.RAMOS,D.C.C.CASANOVA,A.D.A.MORANDIM,D.C.B.BER GAMO,A.J.CAVALHEIRO,
Literature Reference Citation J.NAT.PROD.,67,1783(2004)
Literature Reference DOI 10.1021/np030530j
Molecular Weight 254.283 g/mol
Solvent CDCl3
Source File Reference UWMZ6646