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Methyl (6RS,8RS,9SR)-8-hydroxy-8-isopropyl-9-methyl-5,6,7,8,9,10-hexahydro-benzo[8]annulene-6-carboxylate
SpectraBase Compound ID COpWILGoKKc
InChI InChI=1S/C18H26O3/c1-12(2)18(20)11-16(17(19)21-4)10-15-8-6-5-7-14(15)9-13(18)3/h5-8,12-13,16,20H,9-11H2,1-4H3/t13-,16+,18+/m0/s1
InChIKey OJQXRUBQHPDFEP-FDQGKXFDSA-N
Mol Weight 290.4 g/mol
Molecular Formula C18H26O3
Exact Mass 290.188195 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 31h9DmoyUgm
Name METHYL-(6RS,8RS,9SR)-8-HYDROXY-8-ISOPROPYL-9-METHYL-5,6,7,8,9,10-HEXAHYDRO-BENZO-[8]-ANNULENE-6-CARBOXYLATE
Compound Number 25
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H26O3
InChI InChI=1S/C18H26O3/c1-12(2)18(20)11-16(17(19)21-4)10-15-8-6-5-7-14(15)9-13(18)3/h5-8,12-13,16,20H,9-11H2,1-4H3/t13-,16+,18+/m0/s1
InChIKey OJQXRUBQHPDFEP-FDQGKXFDSA-N
Literature Reference Author J.SAADI,I.BRUEDGAM,H.U.REISSIG
Literature Reference Citation BEIL.J.ORG.CHEM.,6,1229(2010)
Literature Reference DOI 10.3762/bjoc.6.141
Molecular Weight 290.403 g/mol
Solvent DMSO-D6
Source File Reference UWBT10279