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alpha-[(p-chlorophenyl)sulfonyl]-5-[3-(2-chloro-6-fluorobenzoyl)ureido]-o-anisic acid, methyl ester

View entire compound with spectra: 2 NMR, and 1 FTIR

alpha-[(p-chlorophenyl)sulfonyl]-5-[3-(2-chloro-6-fluorobenzoyl)ureido]-o-anisic acid, methyl ester
SpectraBase Compound ID JVT7V8oWM4Z
InChI InChI=1S/C23H17Cl2FN2O7S/c1-34-22(30)16-11-14(27-23(31)28-21(29)20-17(25)3-2-4-18(20)26)7-10-19(16)35-12-36(32,33)15-8-5-13(24)6-9-15/h2-11H,12H2,1H3,(H2,27,28,29,31)
InChIKey BERFZZSFIMUBLJ-UHFFFAOYSA-N
Mol Weight 555.36 g/mol
Molecular Formula C23H17Cl2FN2O7S
Exact Mass 554.011756 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CJU7Vn0OFJg
Name alpha-[(p-CHLOROPHENYL)SULFONYL]-5-[3-(2-CHLORO-6-FLUOROBENZOYL)UREIDO]-o-ANISIC ACID, METHYL ESTER
Source of Sample Maybridge Chemical Company Ltd., North Cornwall, England
Copyright Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H17Cl2FN2O7S
InChI InChI=1S/C23H17Cl2FN2O7S/c1-34-22(30)16-11-14(27-23(31)28-21(29)20-17(25)3-2-4-18(20)26)7-10-19(16)35-12-36(32,33)15-8-5-13(24)6-9-15/h2-11H,12H2,1H3,(H2,27,28,29,31)
InChIKey BERFZZSFIMUBLJ-UHFFFAOYSA-N
Instrument Name BRUKER AC-300
Melting Point 180-182C
Molecular Weight 555.37
Solvent Polysol; Reference=TMS; Temperature 297K