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Methyl 4-cyanobenzoate

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Methyl 4-cyanobenzoate
SpectraBase Compound ID 8uPvy7rTgSc
InChI InChI=1S/C9H7NO2/c1-12-9(11)8-4-2-7(6-10)3-5-8/h2-5H,1H3
InChIKey KKZMIDYKRKGJHG-UHFFFAOYSA-N
Mol Weight 161.16 g/mol
Molecular Formula C9H7NO2
Exact Mass 161.047678 g/mol

17O Nuclear Magnetic Resonance (NMR) Chemical Shifts

17O Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KRIkTLBvGlZ
Name 4-CYANO-BENZOIC-ACID,METHYLESTER
CAS Registry Number 1129-35-7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H7NO2
InChI InChI=1S/C9H7NO2/c1-12-9(11)8-4-2-7(6-10)3-5-8/h2-5H,1H3
InChIKey KKZMIDYKRKGJHG-UHFFFAOYSA-N
Literature Reference Author P.BALAKRISHNAN,A.L.BAUMSTARK,D.W.BOYKIN
Literature Reference Citation ORG.MAGN.RES.,22,753(1984)
Literature Reference DOI 10.1002/mrc.1270221204
Solvent ACETONE
Source File Reference UNIO822