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5-(2-Chloro-4-trifluoromethyl-phenoxy)-2-nitro-B enzoic acid, N-methanesulfonyl amide

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5-(2-Chloro-4-trifluoromethyl-phenoxy)-2-nitro-B enzoic acid, N-methanesulfonyl amide
SpectraBase Compound ID 98XyqYMHfCo
InChI InChI=1S/C15H10ClF3N2O6S/c1-28(25,26)20-14(22)10-7-9(3-4-12(10)21(23)24)27-13-5-2-8(6-11(13)16)15(17,18)19/h2-7H,1H3,(H,20,22)
InChIKey BGZZWXTVIYUUEY-UHFFFAOYSA-N
Mol Weight 438.76 g/mol
Molecular Formula C15H10ClF3N2O6S
Exact Mass 437.990019 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FUuIbQ9pPK5
Name 5-(2-Chloro-4-trifluoromethyl-phenoxy)-2-nitro-B enzoic acid, N-methanesulfonyl amide
CAS Registry Number 72178-02-0
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C15H10ClF3N2O6S
InChI InChI=1S/C15H10ClF3N2O6S/c1-28(25,26)20-14(22)10-7-9(3-4-12(10)21(23)24)27-13-5-2-8(6-11(13)16)15(17,18)19/h2-7H,1H3,(H,20,22)
InChIKey BGZZWXTVIYUUEY-UHFFFAOYSA-N
Instrument Name Bruker AM-270
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3/DMSO-D6