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2,7-DINITRO-TRANS-10B,10C-DIMETHYLDIHYDROPYRENE
SpectraBase Compound ID KxE2d6bikWX
InChI InChI=1S/C18H14N2O4/c1-17-11-3-5-13-9-16(20(23)24)10-14(18(13,17)2)6-4-12(17)8-15(7-11)19(21)22/h3-10H,1-2H3/t17-,18-
InChIKey DFVISBJVIQWFDH-IYARVYRRSA-N
Mol Weight 322.32 g/mol
Molecular Formula C18H14N2O4
Exact Mass 322.095357 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HeVvuYsI4BA
Name 2,7-DINITRO-TRANS-10B,10C-DIMETHYLDIHYDROPYRENE
Compound Number 13
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H14N2O4
InChI InChI=1S/C18H14N2O4/c1-17-11-3-5-13-9-16(20(23)24)10-14(18(13,17)2)6-4-12(17)8-15(7-11)19(21)22/h3-10H,1-2H3/t17-,18-
InChIKey DFVISBJVIQWFDH-IYARVYRRSA-N
Literature Reference Author K.K.LAALI,M.TANAKA,R.H.MITCHELL,D.Y.K.LAU
Literature Reference Citation J.ORG.CHEM.,63,3059(1998)
Literature Reference DOI 10.1021/jo972324k
Molecular Weight 322.320 g/mol
Sample ID 26669
Solvent CDCl3