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3-Hydroxy-2,2-dimethyl-3-phenylheptanenitrile
SpectraBase Compound ID J1xJKsU6pEU
InChI InChI=1S/C15H21NO/c1-4-5-11-15(17,14(2,3)12-16)13-9-7-6-8-10-13/h6-10,17H,4-5,11H2,1-3H3
InChIKey KYPQDJGKFXXVAA-UHFFFAOYSA-N
Mol Weight 231.34 g/mol
Molecular Formula C15H21NO
Exact Mass 231.162314 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DB7erUFufeW
Name 3-HYDROXY-2,2-DIMETHYL-3-PHENYLHEPTANENITRILE
CAS Registry Number 138902-43-9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H21NO
InChI InChI=1S/C15H21NO/c1-4-5-11-15(17,14(2,3)12-16)13-9-7-6-8-10-13/h6-10,17H,4-5,11H2,1-3H3
InChIKey KYPQDJGKFXXVAA-UHFFFAOYSA-N
Literature Reference Author T.KAUFFMANN,H.KIEPER
Literature Reference Citation CHEM.BER.,125,907(1992)
Literature Reference DOI 10.1002/cber.19921250423
Molecular Weight 231.338 g/mol
Solvent CDCl3
Source File Reference UWCS7473