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4-CYANOBENZYLACETATE;4-[(ACETYLOXY)-METHYL]-BENZONITRILE
SpectraBase Compound ID HClwlhUbZV3
InChI InChI=1S/C10H9NO2/c1-8(12)13-7-10-4-2-9(6-11)3-5-10/h2-5H,7H2,1H3
InChIKey GNYSLHQZULGATB-UHFFFAOYSA-N
Mol Weight 175.19 g/mol
Molecular Formula C10H9NO2
Exact Mass 175.063329 g/mol

17O Nuclear Magnetic Resonance (NMR) Chemical Shifts

17O Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DEHlsbvBdb1
Name 4-CYANOBENZYLACETATE;4-[(ACETYLOXY)-METHYL]-BENZONITRILE
CAS Registry Number 21388-95-4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C10H9NO2
InChI InChI=1S/C10H9NO2/c1-8(12)13-7-10-4-2-9(6-11)3-5-10/h2-5H,7H2,1H3
InChIKey GNYSLHQZULGATB-UHFFFAOYSA-N
Literature Reference Author P.BALAKRISHNAN,A.L.BAUMSTARK,D.W.BOYKIN
Literature Reference Citation TETRAH.LETT.,25,169(1984)
Literature Reference DOI 10.1016/S0040-4039(00)99831-9
Solvent ACETONE
Source File Reference UNIO20