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3-Hydroxy-2,2-dimethyl-3-phenylpentanenitrile
SpectraBase Compound ID AH4LWRNZxh
InChI InChI=1S/C13H17NO/c1-4-13(15,12(2,3)10-14)11-8-6-5-7-9-11/h5-9,15H,4H2,1-3H3
InChIKey PIVKODMDBLLGKP-UHFFFAOYSA-N
Mol Weight 203.28 g/mol
Molecular Formula C13H17NO
Exact Mass 203.131014 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BBZmUWX2GvJ
Name 3-HYDROXY-2,2-DIMETHYL-3-PHENYLPENTANENITRILE
CAS Registry Number 138902-41-7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H17NO
InChI InChI=1S/C13H17NO/c1-4-13(15,12(2,3)10-14)11-8-6-5-7-9-11/h5-9,15H,4H2,1-3H3
InChIKey PIVKODMDBLLGKP-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 203.284 g/mol
Solvent CDCl3
Source File Reference UWCS7471