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trans-1,3-Dimethylcycloheptane

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trans-1,3-Dimethylcycloheptane
SpectraBase Compound ID H7dnLL2CzKb
InChI InChI=1S/C9H18/c1-8-5-3-4-6-9(2)7-8/h8-9H,3-7H2,1-2H3/t8-,9-/m1/s1
InChIKey PTWXFJWKUMXFLI-RKDXNWHRSA-N
Mol Weight 126.24 g/mol
Molecular Formula C9H18
Exact Mass 126.140851 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6Nuh6BD921J
Name TRANS-1,3-DIMETHYLCYCLOHEPTANE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H18
InChI InChI=1S/C9H18/c1-8-5-3-4-6-9(2)7-8/h8-9H,3-7H2,1-2H3/t8-,9-/m1/s1
InChIKey PTWXFJWKUMXFLI-RKDXNWHRSA-N
Literature Reference Author M.CHRISTL,J.D.ROBERTS
Literature Reference Citation J.ORG.CHEM.,37,3443(1972)
Literature Reference DOI 10.1021/jo00795a014
Molecular Weight 126.242 g/mol
Solvent CS2
Source File Reference UNIW13983