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4-METHYLCINNAMONITRILE
SpectraBase Compound ID 8Nc7R3mLYAj
InChI InChI=1S/2C10H9N/c2*1-9-4-6-10(7-5-9)3-2-8-11/h2*2-7H,1H3/b2*3-2+
InChIKey XWXOYHNDIOOZSB-XQHVRGAUSA-N
Mol Weight 286.38 g/mol
Molecular Formula C20H18N2
Exact Mass 286.146999 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6nZUmKR68jI
Name 4-METHYLCINNAMONITRILE
Source of Sample Aldrich Chemical Company, Inc., Milwaukee, Wisconsin
Comments Tentative assignment
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H9N
InChI InChI=1S/2C10H9N/c2*1-9-4-6-10(7-5-9)3-2-8-11/h2*2-7H,1H3/b2*3-2+
InChIKey XWXOYHNDIOOZSB-XQHVRGAUSA-N
Molecular Weight 143.19
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20
Synonyms CINNAMONITRILE, 4-METHYL-,