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[3-(BENZYLOXY)-4-METHOXY-2-(METHOXYMETHYL)-6-NITROPHENYL]-ACETONITRILE
SpectraBase Compound ID I64HdHXQN6M
InChI InChI=1S/C18H18N2O5/c1-23-12-15-14(8-9-19)16(20(21)22)10-17(24-2)18(15)25-11-13-6-4-3-5-7-13/h3-7,10H,8,11-12H2,1-2H3
InChIKey KBBJEFUPQQVVMA-UHFFFAOYSA-N
Mol Weight 342.35 g/mol
Molecular Formula C18H18N2O5
Exact Mass 342.121572 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5JyXvtCpEap
Name [3-(BENZYLOXY)-4-METHOXY-2-(METHOXYMETHYL)-6-NITROPHENYL]-ACETONITRILE
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H18N2O5
InChI InChI=1S/C18H18N2O5/c1-23-12-15-14(8-9-19)16(20(21)22)10-17(24-2)18(15)25-11-13-6-4-3-5-7-13/h3-7,10H,8,11-12H2,1-2H3
InChIKey KBBJEFUPQQVVMA-UHFFFAOYSA-N
Literature Reference Author G.GROSZEK,A.BAJEK,A.BIS,A.NOWAK-KROL,M.BEDNARSKI,A.SIWEK,B.F ILIPEK
Literature Reference Citation MOLECULES,15,3887(2010)
Literature Reference DOI 10.3390/molecules15063887
Molecular Weight 342.351 g/mol
Sample ID 70937
Solvent CDCl3