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(1R,2S)-2-methylol-1-(4-methylphenyl)cyclopropane-1-carbonitrile
SpectraBase Compound ID 3ZQH7cixvj7
InChI InChI=1S/C12H13NO/c1-9-2-4-10(5-3-9)12(8-13)6-11(12)7-14/h2-5,11,14H,6-7H2,1H3/t11-,12+/m1/s1
InChIKey CIBGDKPOBCTCCK-NEPJUHHUSA-N
Mol Weight 187.24 g/mol
Molecular Formula C12H13NO
Exact Mass 187.099714 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LI2CTcL6aCx
Name (1R,2S)-2-methylol-1-(4-methylphenyl)cyclopropane-1-carbonitrile
Compound Number 3B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H13NO
InChI InChI=1S/C12H13NO/c1-9-2-4-10(5-3-9)12(8-13)6-11(12)7-14/h2-5,11,14H,6-7H2,1H3/t11-,12+/m1/s1
InChIKey CIBGDKPOBCTCCK-NEPJUHHUSA-N
Literature Reference Author P.LANGER,I.FREIFELD
Literature Reference Citation ORG.LETTERS,3,3903(2001)
Literature Reference DOI 10.1021/ol010207c
Molecular Weight 187.241 g/mol
Solvent CDCl3
Source File Reference UWLU33958