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(+)-(1R,4S)-1,7,7-Trimethyl-3-isopropylidene-bicyclo-[2.2.1]-heptan-2-one
SpectraBase Compound ID 3gkoKB70g5s
InChI InChI=1S/C13H20O/c1-8(2)10-9-6-7-13(5,11(10)14)12(9,3)4/h9H,6-7H2,1-5H3/t9-,13+/m0/s1
InChIKey ADORFBVFEJSRDX-TVQRCGJNSA-N
Mol Weight 192.3 g/mol
Molecular Formula C13H20O
Exact Mass 192.151415 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 16K1EobpixC
Name (+)-(1R,4S)-1,7,7-TRIMETHYL-3-ISOPROPYLIDENE-BICYCLO-[2.2.1]-HEPTAN-2-ONE
CAS Registry Number 25861-51-2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H20O
InChI InChI=1S/C13H20O/c1-8(2)10-9-6-7-13(5,11(10)14)12(9,3)4/h9H,6-7H2,1-5H3/t9-,13+/m0/s1
InChIKey ADORFBVFEJSRDX-TVQRCGJNSA-N
Literature Reference Author D.A.LIGHTNER,M.J.FLORES,B.V.CRIST,J.K.GAWRONSKI
Literature Reference Citation J.ORG.CHEM.,45,3518(1980)
Literature Reference DOI 10.1021/jo01305a033
Molecular Weight 192.301 g/mol
Solvent CDCl3
Source File Reference UNIW18631