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3-HYDROXY-5-METHOXY-2,2,4-TRIMETHYL-3-PHENYLPENTANNITRILE;DIASTEREOMER-#1
SpectraBase Compound ID KeT4DgFzHJn
InChI InChI=1S/C15H21NO2/c1-12(10-18-4)15(17,14(2,3)11-16)13-8-6-5-7-9-13/h5-9,12,17H,10H2,1-4H3
InChIKey QVJQCIRXDPQLTF-UHFFFAOYSA-N
Mol Weight 247.34 g/mol
Molecular Formula C15H21NO2
Exact Mass 247.157229 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2Yh1TQmVyrg
Name 3-HYDROXY-5-METHOXY-2,2,4-TRIMETHYL-3-PHENYLPENTANNITRILE;DIASTEREOMER-#1
CAS Registry Number 138902-34-8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H21NO2
InChI InChI=1S/C15H21NO2/c1-12(10-18-4)15(17,14(2,3)11-16)13-8-6-5-7-9-13/h5-9,12,17H,10H2,1-4H3
InChIKey QVJQCIRXDPQLTF-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 247.337 g/mol
Solvent CDCl3
Source File Reference UWCS7462