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(2S,4aR,8aR)-4-ketodecalin-2-carboxylic acid methyl ester
SpectraBase Compound ID 7LReBqp4Qu3
InChI InChI=1S/C12H18O3/c1-15-12(14)9-6-8-4-2-3-5-10(8)11(13)7-9/h8-10H,2-7H2,1H3/t8-,9+,10-/m1/s1
InChIKey JQWCGPJOYIEWEN-KXUCPTDWSA-N
Mol Weight 210.27 g/mol
Molecular Formula C12H18O3
Exact Mass 210.125594 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1RIiLiOrA5r
Name (2S,4aR,8aR)-4-ketodecalin-2-carboxylic acid methyl ester
CAS Registry Number 123149-23-5
Compound Number CIS-17
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H18O3
InChI InChI=1S/C12H18O3/c1-15-12(14)9-6-8-4-2-3-5-10(8)11(13)7-9/h8-10H,2-7H2,1H3/t8-,9+,10-/m1/s1
InChIKey JQWCGPJOYIEWEN-KXUCPTDWSA-N
Literature Reference Author R.ZSCHIESCHE,B.FREY,E.GRIMM,H.U.REISSIG
Literature Reference Citation CHEM.BER.,123,363(1990)
Literature Reference DOI 10.1002/cber.19901230223
Molecular Weight 210.273 g/mol
Solvent CDCl3
Source File Reference UWED13737