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(AS)-(4-METHYL-CYClOHEXYLIDENE)-ACETONITRILE;VITAMIN-D-DERIVATIVE
SpectraBase Compound ID 8jK8Rr5TzW7
InChI InChI=1S/C9H13N/c1-8-2-4-9(5-3-8)6-7-10/h6,8H,2-5H2,1H3/b9-6-/t8-/m0/s1
InChIKey QMUPUTCNIUGNQK-HWPCKVLBSA-N
Mol Weight 135.21 g/mol
Molecular Formula C9H13N
Exact Mass 135.104799 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7as0723t59
Name (AS)-(4-METHYL-CYClOHEXYLIDENE)-ACETONITRILE;VITAMIN-D-DERIVATIVE
CAS Registry Number 102633-45-4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H13N
InChI InChI=1S/C9H13N/c1-8-2-4-9(5-3-8)6-7-10/h6,8H,2-5H2,1H3/b9-6-/t8-/m0/s1
InChIKey QMUPUTCNIUGNQK-HWPCKVLBSA-N
Literature Reference Author J.K.GAWRONSKI,H.M.WALBORSKY
Literature Reference Citation J.ORG.CHEM.,51,2863(1986)
Literature Reference DOI 10.1021/jo00365a002
Molecular Weight 135.209 g/mol
Solvent CDCl3
Source File Reference UWWR5114