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4-(3-CYANOPROPYL)-BENZOIC-ACID

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4-(3-CYANOPROPYL)-BENZOIC-ACID
SpectraBase Compound ID LkAQy3TO5UW
InChI InChI=1S/C11H11NO2/c12-8-2-1-3-9-4-6-10(7-5-9)11(13)14/h4-7H,1-3H2,(H,13,14)
InChIKey VBKOLIZQULKKQB-UHFFFAOYSA-N
Mol Weight 189.21 g/mol
Molecular Formula C11H11NO2
Exact Mass 189.078979 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8AkZXVD6Gns
Name 4-(3-CYANOPROPYL)-BENZOIC-ACID
Compound Number 14G
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H11NO2
InChI InChI=1S/C11H11NO2/c12-8-2-1-3-9-4-6-10(7-5-9)11(13)14/h4-7H,1-3H2,(H,13,14)
InChIKey VBKOLIZQULKKQB-UHFFFAOYSA-N
Literature Reference Author A.BRAMBORG,T.LINKER
Literature Reference Citation EUR.J.ORG.CHEM.,2012,5552(2012)
Literature Reference DOI 10.1002/ejoc.201200823
Molecular Weight 189.214 g/mol
Solvent CDCl3
Source File Reference UWLU83557