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trans-6,7-DIMETHYL-1-NITRO-4-TRINITROMETHYL-1,4-DIHYDRO-NAPHTHALENE
SpectraBase Compound ID BPevdOl77KK
InChI InChI=1S/C13H12N4O8/c1-7-5-9-10(6-8(7)2)12(14(18)19)4-3-11(9)13(15(20)21,16(22)23)17(24)25/h3-6,11-12H,1-2H3/t11-,12-/m0/s1
InChIKey XJIZAKQKIYWZKV-RYUDHWBXSA-N
Mol Weight 352.26 g/mol
Molecular Formula C13H12N4O8
Exact Mass 352.065513 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EkB4FCxAfea
Name trans-6,7-DIMETHYL-1-NITRO-4-TRINITROMETHYL-1,4-DIHYDRO-NAPHTHALENE
Compound Number 8
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C13H12N4O8/c1-7-5-9-10(6-8(7)2)12(14(18)19)4-3-11(9)13(15(20)21,16(22)23)17(24)25/h3-6,11-12H,1-2H3/t11-,12-/m0/s1
InChIKey XJIZAKQKIYWZKV-RYUDHWBXSA-N
Literature Reference C.P.BUTTS,J.L.CALVERT,L.EBERSON,M.P.HARTSHORN,F.RADNER,W.T.ROBINSON J.CHEM.SOC.PERKIN-2,1485(1994)
Solvent Chloroform-d