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N-(2,6-DINITRO-4-TRIFLUOROMETHYLPHENYL)VALINE METHYL ESTER
SpectraBase Compound ID 8l1prT4cmYo
InChI InChI=1S/C13H14F3N3O6/c1-6(2)10(12(20)25-3)17-11-8(18(21)22)4-7(13(14,15)16)5-9(11)19(23)24/h4-6,10,17H,1-3H3
InChIKey WJJWNZUIWFXJTL-UHFFFAOYSA-N
Mol Weight 365.27 g/mol
Molecular Formula C13H14F3N3O6
Exact Mass 365.08347 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID I09KmnA1rwf
Name N-(2,6-DINITRO-4-TRIFLUOROMETHYLPHENYL)VALINE METHYL ESTER
Comments THE SOLVENT IS CDCL3 OR DMSO-D6. SCALE INVERTED
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C13H14F3N3O6
InChI InChI=1S/C13H14F3N3O6/c1-6(2)10(12(20)25-3)17-11-8(18(21)22)4-7(13(14,15)16)5-9(11)19(23)24/h4-6,10,17H,1-3H3
InChIKey WJJWNZUIWFXJTL-UHFFFAOYSA-N
Instrument Name Varian XL-200
Literature Reference CHING-SUNG CHI, MEI-JEN CHEN, SHI-QUIN LIANG, DE-HUA CHEN (1988) J.Fluor.Chem.:v.38, N3, 327-334.
NMR Standard -CF3COOH
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent not reported