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TRIETHYLAMMONIUM 6-ACETYL-2,4,9-TRINITRO-7-OXOBICYCLO[3.3.1]NON-2-EN-4-OATE, ENOL

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TRIETHYLAMMONIUM 6-ACETYL-2,4,9-TRINITRO-7-OXOBICYCLO[3.3.1]NON-2-EN-4-OATE, ENOL
SpectraBase Compound ID 6Nz6OUEoGYa
InChI InChI=1S/C11H10N3O8.C6H15N/c1-4(15)9-8(16)2-5-6(12(17)18)3-7(13(19)20)10(9)11(5)14(21)22;1-4-7(5-2)6-3/h3,5,10-11,15H,2H2,1H3;4-6H2,1-3H3/q-1;/p+1/b9-4+;/t5-,10-,11+;/m1./s1
InChIKey PURRFPZPXHDUOG-QNSLAKOPSA-O
Mol Weight 416.43 g/mol
Molecular Formula C17H28N4O8
Exact Mass 416.190714 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CL25w5bL1Ug
Name TRIETHYLAMMONIUM 6-ACETYL-2,4,9-TRINITRO-7-OXOBICYCLO[3.3.1]NON-2-EN-4-OATE, ENOL
Comments ##
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C17H28N4O8
InChI InChI=1S/C11H10N3O8.C6H15N/c1-4(15)9-8(16)2-5-6(12(17)18)3-7(13(19)20)10(9)11(5)14(21)22;1-4-7(5-2)6-3/h3,5,10-11,15H,2H2,1H3;4-6H2,1-3H3/q-1;/p+1/b9-4+;/t5-,10-,11+;/m1./s1
InChIKey PURRFPZPXHDUOG-QNSLAKOPSA-O
Instrument Name Jeol FX-100
Literature Reference V.MACHACEK, A.LYCKA (1984) Coll.Czech.Chem.Comm.: v.49, N1, 244-252.
NMR Standard DMSO-D6
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent C2D6SO dimethylsulfo