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4-(1,3-DIOXACYCLOPENT-2-YL)-BENZONITRILE

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4-(1,3-DIOXACYCLOPENT-2-YL)-BENZONITRILE
SpectraBase Compound ID GnMHeNG7CVq
InChI InChI=1S/C10H9NO2/c11-7-8-1-3-9(4-2-8)10-12-5-6-13-10/h1-4,10H,5-6H2
InChIKey AQXQCWAXQJVTKU-UHFFFAOYSA-N
Mol Weight 175.19 g/mol
Molecular Formula C10H9NO2
Exact Mass 175.063329 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1wMqJjWGKBw
Name 4-(1,3-DIOXACYCLOPENT-2-YL)-BENZONITRILE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C10H9NO2
InChI InChI=1S/C10H9NO2/c11-7-8-1-3-9(4-2-8)10-12-5-6-13-10/h1-4,10H,5-6H2
InChIKey AQXQCWAXQJVTKU-UHFFFAOYSA-N
Literature Reference Author O.OUARI,A.POLIDORI,B.PUCCI,P.TORDO,F.CHALIER
Literature Reference Citation J.ORG.CHEM.,64,3554(1999)
Literature Reference DOI 10.1021/jo982343+
Molecular Weight 175.187 g/mol
Sample ID 59230
Solvent CDCl3