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(+)-2-Isobutylapopinene

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(+)-2-Isobutylapopinene
SpectraBase Compound ID CzwpaHunUBb
InChI InChI=1S/C13H22/c1-9(2)7-10-5-6-11-8-12(10)13(11,3)4/h5,9,11-12H,6-8H2,1-4H3/t11-,12-/m1/s1
InChIKey DNJQMHNDXVWEHO-VXGBXAGGSA-N
Mol Weight 178.32 g/mol
Molecular Formula C13H22
Exact Mass 178.172151 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ce5LEdg4OaD
Name (+)-2-ISOBUTYLAPOPINENE
Compound Number 1D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H22
InChI InChI=1S/C13H22/c1-9(2)7-10-5-6-11-8-12(10)13(11,3)4/h5,9,11-12H,6-8H2,1-4H3/t11-,12-/m1/s1
InChIKey DNJQMHNDXVWEHO-VXGBXAGGSA-N
Literature Reference Author H.C.BROWN,U.P.DHOKTE
Literature Reference Citation J.ORG.CHEM.,59,2025(1994)
Literature Reference DOI 10.1021/jo00087a016
Molecular Weight 178.318 g/mol
Solvent CDCl3
Source File Reference UWCP4932