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N-[(3-chloro-4-fluorophenyl)sulfonyl]phenylalanine

View entire compound with spectra: 1 NMR

N-[(3-chloro-4-fluorophenyl)sulfonyl]phenylalanine
SpectraBase Compound ID 9Ap9fI81nX9
InChI InChI=1S/C15H13ClFNO4S/c16-12-9-11(6-7-13(12)17)23(21,22)18-14(15(19)20)8-10-4-2-1-3-5-10/h1-7,9,14,18H,8H2,(H,19,20)
InChIKey NJWNKXRKNANWCI-UHFFFAOYSA-N
Mol Weight 357.78 g/mol
Molecular Formula C15H13ClFNO4S
Exact Mass 357.023785 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID B07STepkIpp
Name N-[(3-chloro-4-fluorophenyl)sulfonyl]phenylalanine
Copyright Copyright © 2022-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 357.023784936 u
Formula C15H13ClFNO4S
InChI InChI=1S/C15H13ClFNO4S/c16-12-9-11(6-7-13(12)17)23(21,22)18-14(15(19)20)8-10-4-2-1-3-5-10/h1-7,9,14,18H,8H2,(H,19,20)
InChIKey NJWNKXRKNANWCI-UHFFFAOYSA-N
Molecular Weight 357.783 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_2608
Solvent DMSO-d6
Source Vendor ID: NMR/12279707