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4-NITRO-1,2-BENZODIOXEPANE

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4-NITRO-1,2-BENZODIOXEPANE
SpectraBase Compound ID KItNCZhjEFX
InChI InChI=1S/C9H9NO4/c11-10(12)7-2-3-8-9(6-7)14-5-1-4-13-8/h2-3,6H,1,4-5H2
InChIKey DYLOYOGDBJZJDV-UHFFFAOYSA-N
Mol Weight 195.17 g/mol
Molecular Formula C9H9NO4
Exact Mass 195.053158 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2UuSyy2i5xK
Name 4-NITRO-1,2-BENZODIOXEPANE
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H9NO4
InChI InChI=1S/C9H9NO4/c11-10(12)7-2-3-8-9(6-7)14-5-1-4-13-8/h2-3,6H,1,4-5H2
InChIKey DYLOYOGDBJZJDV-UHFFFAOYSA-N
Literature Reference Author G.W.BUCHANAN,A.B.DRIEGA,C.I.RATCLIFFE
Literature Reference Citation MAGN.RES.CHEM.,31,1094(1993)
Literature Reference DOI 10.1002/mrc.1260311214
Molecular Weight 195.175 g/mol
Solvent CDCl3;C=0.1M
Source File Reference UWAT13