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METHYL-(6RS,8RS,9RS)-9-CYCLOPROPYL-8-HYDROXY-8-ISOPROPYL-5,6,7,8,9,10-HEXAHYDRO-BENZO-[8]-ANNULENE-6-CARBOXYLATE
SpectraBase Compound ID 1nRJUReSwK9
InChI InChI=1S/C20H28O3/c1-13(2)20(22)12-17(19(21)23-3)10-15-6-4-5-7-16(15)11-18(20)14-8-9-14/h4-7,13-14,17-18,22H,8-12H2,1-3H3/t17-,18-,20-/m1/s1
InChIKey YYJNMJAXSFVYKO-QWFCFKBJSA-N
Mol Weight 316.44 g/mol
Molecular Formula C20H28O3
Exact Mass 316.203845 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GOaTkb1VsSr
Name METHYL-(6RS,8RS,9RS)-9-CYCLOPROPYL-8-HYDROXY-8-ISOPROPYL-5,6,7,8,9,10-HEXAHYDRO-BENZO-[8]-ANNULENE-6-CARBOXYLATE
Compound Number 34
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H28O3
InChI InChI=1S/C20H28O3/c1-13(2)20(22)12-17(19(21)23-3)10-15-6-4-5-7-16(15)11-18(20)14-8-9-14/h4-7,13-14,17-18,22H,8-12H2,1-3H3/t17-,18-,20-/m1/s1
InChIKey YYJNMJAXSFVYKO-QWFCFKBJSA-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 316.441 g/mol
Solvent CDCl3
Source File Reference UWBT10283