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TRANS-1-DEUTERIO-3,3-DIMETHYL-1-BUTENE

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TRANS-1-DEUTERIO-3,3-DIMETHYL-1-BUTENE
SpectraBase Compound ID 8j4UwOXaKpw
InChI InChI=1S/C6H12/c1-5-6(2,3)4/h5H,1H2,2-4H3/i1D/b5-1+
InChIKey PKXHXOTZMFCXSH-GCBGRLCTSA-N
Mol Weight 85.17 g/mol
Molecular Formula C6H112H
Exact Mass 85.100177 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3YNGahN2Lbt
Name TRANS-1-DEUTERIO-3,3-DIMETHYL-1-BUTENE
Compound Number 7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C6H112H
InChI InChI=1S/C6H12/c1-5-6(2,3)4/h5H,1H2,2-4H3/i1D/b5-1+
InChIKey PKXHXOTZMFCXSH-GCBGRLCTSA-N
Literature Reference Author K.MATOS,J.A.SODERQUIST
Literature Reference Citation J.ORG.CHEM.,63,461(1998)
Literature Reference DOI 10.1021/jo971681s
Molecular Weight 85.167 g/mol
Sample ID 33232
Solvent C6D6