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2,5-DINITROHEX-3-ENE;DIASTEREOMER-#1
SpectraBase Compound ID 4yIvsHeabD0
InChI InChI=1S/C6H10N2O4/c1-5(7(9)10)3-4-6(2)8(11)12/h3-6H,1-2H3/b4-3+
InChIKey IQBYPHARADUNFA-ONEGZZNKSA-N
Mol Weight 174.16 g/mol
Molecular Formula C6H10N2O4
Exact Mass 174.064057 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 86FpKmJq2Tp
Name 2,5-DINITROHEX-3-ENE;DIASTEREOMER-#1
Compound Number 7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C6H10N2O4
InChI InChI=1S/C6H10N2O4/c1-5(7(9)10)3-4-6(2)8(11)12/h3-6H,1-2H3/b4-3+
InChIKey IQBYPHARADUNFA-ONEGZZNKSA-N
Literature Reference Author R.P.CLARIDGE,A.J.DEEMING,N.PAUL,D.A.TOCHER,J.H.RIDD
Literature Reference Citation J.CHEM.SOC.PERKIN-1,3523(1998)
Literature Reference DOI 10.1039/a806451b
Molecular Weight 174.156 g/mol
Solvent CDCl3
Source File Reference UWCP9278