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5-(2'-HYDROXY-4'-METHOXYPHENYL)-7A-BETA-METHYL-1-OXO-2,3,3A-ALPHA,4,5,6,7,7A-OCTAHYDRO-1H-INDENE-4-ZETA-CARBOXYLIC-ACID
SpectraBase Compound ID 8m8ieHoyrl
InChI InChI=1S/C18H22O5/c1-18-8-7-12(11-4-3-10(23-2)9-14(11)19)16(17(21)22)13(18)5-6-15(18)20/h3-4,9,12-13,16,19H,5-8H2,1-2H3,(H,21,22)/t12?,13?,16?,18-/m0/s1
InChIKey QURLSKANUJMRHT-LOZFGHRWSA-N
Mol Weight 318.37 g/mol
Molecular Formula C18H22O5
Exact Mass 318.146724 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CQsFSVoTQSZ
Name 5-(2'-HYDROXY-4'-METHOXYPHENYL)-7A-BETA-METHYL-1-OXO-2,3,3A-ALPHA,4,5,6,7,7A-OCTAHYDRO-1H-INDENE-4-ZETA-CARBOXYLIC-ACID
Compound Number 24A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H22O5
InChI InChI=1S/C18H22O5/c1-18-8-7-12(11-4-3-10(23-2)9-14(11)19)16(17(21)22)13(18)5-6-15(18)20/h3-4,9,12-13,16,19H,5-8H2,1-2H3,(H,21,22)/t12?,13?,16?,18-/m0/s1
InChIKey QURLSKANUJMRHT-LOZFGHRWSA-N
Literature Reference Author D.J.COLLINS,A.G.JHINGRAN,S.B.RUTSCHMANN
Literature Reference Citation AUSTR.J.CHEM.,42,1769(1989)
Literature Reference DOI 10.1071/ch9891769
Molecular Weight 318.370 g/mol
Solvent DMSO-D6
Source File Reference UWRU8722