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2,4,6-trinitroanisole

View entire compound with spectra: 17 NMR, 1 FTIR, and 2 UV-Vis

2,4,6-trinitroanisole
SpectraBase Compound ID AyhqqohexoO
InChI InChI=1S/C7H5N3O7/c1-17-7-5(9(13)14)2-4(8(11)12)3-6(7)10(15)16/h2-3H,1H3
InChIKey FMXDVBRYDYFVGS-UHFFFAOYSA-N
Mol Weight 243.13 g/mol
Molecular Formula C7H5N3O7
Exact Mass 243.01275 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID K2ZRe8jpwAG
Name
CAS Registry Number 606-35-9
Comments reassigned
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C7H5N3O7
InChI InChI=1S/C7H5N3O7/c1-17-7-5(9(13)14)2-4(8(11)12)3-6(7)10(15)16/h2-3H,1H3
InChIKey FMXDVBRYDYFVGS-UHFFFAOYSA-N
Instrument Name Varian CFT-20
Literature Reference C.A. Fyfe, S.W. Damij, A.Koll, J. Am. Chem. Soc. 101, 956 (1979).
NMR Standard DMSO-D6
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6