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[3-TERT.-BUTYL-5-(HYDROXYMETHYL)-PHENYL]-ACETONITRILE
SpectraBase Compound ID F8Td205AQIe
InChI InChI=1S/C13H17NO/c1-13(2,3)12-7-10(4-5-14)6-11(8-12)9-15/h6-8,15H,4,9H2,1-3H3
InChIKey PCMFIDHNGGLGFD-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 2TPq2kEVVyx
Name [3-TERT.-BUTYL-5-(HYDROXYMETHYL)-PHENYL]-ACETONITRILE
Compound Number 7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H17NO
InChI InChI=1S/C13H17NO/c1-13(2,3)12-7-10(4-5-14)6-11(8-12)9-15/h6-8,15H,4,9H2,1-3H3
InChIKey PCMFIDHNGGLGFD-UHFFFAOYSA-N
Literature Reference Author E.ALCALDE,C.AYALA,I.DINARES,N.MESQUIDA
Literature Reference Citation J.ORG.CHEM.,66,2291(2001)
Literature Reference DOI 10.1021/jo0056794
Molecular Weight 203.284 g/mol
Solvent CDCl3
Source File Reference UWLU26520