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2,6-DINITRO-4-TERT.-BUTYLBENZALDEHYDE
SpectraBase Compound ID 5BpnYXf3jsi
InChI InChI=1S/C11H12N2O5/c1-11(2,3)7-4-9(12(15)16)8(6-14)10(5-7)13(17)18/h4-6H,1-3H3
InChIKey UOBWIFYBBSRXBT-UHFFFAOYSA-N
Mol Weight 252.23 g/mol
Molecular Formula C11H12N2O5
Exact Mass 252.074621 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 71Y497dGzFc
Name 2,6-DINITRO-4-TERT.-BUTYLBENZALDEHYDE
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H12N2O5
InChI InChI=1S/C11H12N2O5/c1-11(2,3)7-4-9(12(15)16)8(6-14)10(5-7)13(17)18/h4-6H,1-3H3
InChIKey UOBWIFYBBSRXBT-UHFFFAOYSA-N
Literature Reference Author E.ROSE,A.KOSSANYI,M.QUELQUEJEU,M.SOLEILHAVOUP,F.DUWAVRAN,N.B ERNARD,A.LECAS
Literature Reference Citation J.AM.CHEM.SOC.,118,1567(1996)
Literature Reference DOI 10.1021/ja952580j
Molecular Weight 252.227 g/mol
Sample ID 38340
Solvent CDCl3