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3,5-dinitrobenzoic acid, cyclohexyl ester

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3,5-dinitrobenzoic acid, cyclohexyl ester
SpectraBase Compound ID CuGWYkrMT9x
InChI InChI=1S/C13H14N2O6/c16-13(21-12-4-2-1-3-5-12)9-6-10(14(17)18)8-11(7-9)15(19)20/h6-8,12H,1-5H2
InChIKey WQRHLXDZHGLFIX-UHFFFAOYSA-N
Mol Weight 294.26 g/mol
Molecular Formula C13H14N2O6
Exact Mass 294.085186 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6mfJ1aUgtNu
Name 3,5-DINITROBENZOIC ACID, CYCLOHEXYL ESTER
Source of Sample Philadelphia College of Pharmacy & Science, Philadelphia, Pennsylvania
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14N2O6
InChI InChI=1S/C13H14N2O6/c16-13(21-12-4-2-1-3-5-12)9-6-10(14(17)18)8-11(7-9)15(19)20/h6-8,12H,1-5H2
InChIKey WQRHLXDZHGLFIX-UHFFFAOYSA-N
Melting Point 112C
Molecular Weight 294.27
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20
Synonyms BENZOIC ACID, 3,5-DINITRO-, CYCLOHEXYL ESTER BENZOIC ACID, 3,5-DINITRO-, CYCLOHEXYL ESTER