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2-Chloro-1,5-dinitro-3-(trifluoromethyl)benzene

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2-Chloro-1,5-dinitro-3-(trifluoromethyl)benzene
SpectraBase Compound ID 1Oi3KeEt6xR
InChI InChI=1S/C7H2ClF3N2O4/c8-6-4(7(9,10)11)1-3(12(14)15)2-5(6)13(16)17/h1-2H
InChIKey RLXKADBMLQPLDV-UHFFFAOYSA-N
Mol Weight 270.55 g/mol
Molecular Formula C7H2ClF3N2O4
Exact Mass 269.965519 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 11GB8QhWi1w
Name 2-CHLORO-3,5-DINITRO-alpha,alpha,alpha-TRIFLUOROTOLUENE
Source of Sample Tokyo Kasei Kogyo Company, Ltd., Tokyo, Japan
CAS Registry Number 392-95-0
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H2ClF3N2O4
InChI InChI=1S/C7H2ClF3N2O4/c8-6-4(7(9,10)11)1-3(12(14)15)2-5(6)13(16)17/h1-2H
InChIKey RLXKADBMLQPLDV-UHFFFAOYSA-N
Melting Point 63C
Molecular Weight 270.55
Solvent Chloroform-d; Reference=TMS Spectrometer= Bruker AC-300
Synonyms TOLUENE, 2-CHLORO-3,5-DINITRO-alpha,alpha,alpha-TRIFLUORO-,