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TRANS-3-(1,3-BENZODIOXOL-5-YL)-N,N-DIETHYL-2,4-DIMETHYL-4-NITRO-1-CYCLOBUTEN-1-AMINE
SpectraBase Compound ID JQqwW6uS4jB
InChI InChI=1S/C17H22N2O4/c1-5-18(6-2)16-11(3)15(17(16,4)19(20)21)12-7-8-13-14(9-12)23-10-22-13/h7-9,15H,5-6,10H2,1-4H3
InChIKey TVBDEWIJPSQIHH-UHFFFAOYSA-N
Mol Weight 318.37 g/mol
Molecular Formula C17H22N2O4
Exact Mass 318.157957 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3P9OU8XKuGa
Name TRANS-3-(1,3-BENZODIOXOL-5-YL)-N,N-DIETHYL-2,4-DIMETHYL-4-NITRO-1-CYCLOBUTEN-1-AMINE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H22N2O4
InChI InChI=1S/C17H22N2O4/c1-5-18(6-2)16-11(3)15(17(16,4)19(20)21)12-7-8-13-14(9-12)23-10-22-13/h7-9,15H,5-6,10H2,1-4H3
InChIKey TVBDEWIJPSQIHH-UHFFFAOYSA-N
Literature Reference Author P.J.S.S.VANEIJK,C.OVERKEMPE,W.P.TROMPENAARS,D.N.REINHOUDT,S. HARKEMA
Literature Reference Citation REC.TR.CH.P.-B.,107,40(1988)
Literature Reference DOI 10.1002/recl.19881070203
Molecular Weight 318.373 g/mol
Solvent TOLUENE-D8
Source File Reference UWED4644