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2-{2-[(2-chloro-6-fluorobenzyl)thio]acetanido}-4-methyl-3-thiophenecarboxylic acid, methyl ester
SpectraBase Compound ID 5fa9iheqwAM
InChI InChI=1S/C16H15ClFNO3S2/c1-9-6-24-15(14(9)16(21)22-2)19-13(20)8-23-7-10-11(17)4-3-5-12(10)18/h3-6H,7-8H2,1-2H3,(H,19,20)
InChIKey HRJLZBMDRBGBNF-UHFFFAOYSA-N
Mol Weight 387.87 g/mol
Molecular Formula C16H15ClFNO3S2
Exact Mass 387.016592 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5Pi0KVv96zw
Name 2-{2-[(2-CHLORO-6-FLUOROBENZYL)THIO]ACETAMIDO}-4-METHYL-3-THIOPHENECARBOXYLIC ACID, METHYL ESTER
Source of Sample Maybridge Chemical Company Ltd., North Cornwall, England
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H15ClFNO3S2
InChI InChI=1S/C16H15ClFNO3S2/c1-9-6-24-15(14(9)16(21)22-2)19-13(20)8-23-7-10-11(17)4-3-5-12(10)18/h3-6H,7-8H2,1-2H3,(H,19,20)
InChIKey HRJLZBMDRBGBNF-UHFFFAOYSA-N
Melting Point 70-72C
Molecular Weight 387.88
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20
Synonyms 3-THIOPHENECARBOXYLIC ACID, 2-/2-//2-CHLORO-6-FLUOROBENZYL/THIO/ACETAMIDO/-4-METHYL-, METHYL ESTER