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alanine, N-[4-(chlorodifluoromethoxy)phenyl]-3,3,3-trifluoro-2-[(2-methoxybenzoyl)amino]-, methyl ester
SpectraBase Compound ID 8oYOjR7KtGg
InChI InChI=1S/C19H16ClF5N2O5/c1-30-14-6-4-3-5-13(14)15(28)27-17(16(29)31-2,18(21,22)23)26-11-7-9-12(10-8-11)32-19(20,24)25/h3-10,26H,1-2H3,(H,27,28)
InChIKey YPXCBQIVYREUMA-UHFFFAOYSA-N
Mol Weight 482.79 g/mol
Molecular Formula C19H16ClF5N2O5
Exact Mass 482.06679 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AVa8zGyc45P
Name alanine, N-[4-(chlorodifluoromethoxy)phenyl]-3,3,3-trifluoro-2-[(2-methoxybenzoyl)amino]-, methyl ester
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 482.066790133 u
Formula C19H16ClF5N2O5
InChI InChI=1S/C19H16ClF5N2O5/c1-30-14-6-4-3-5-13(14)15(28)27-17(16(29)31-2,18(21,22)23)26-11-7-9-12(10-8-11)32-19(20,24)25/h3-10,26H,1-2H3,(H,27,28)
InChIKey YPXCBQIVYREUMA-UHFFFAOYSA-N
Molecular Weight 482.791 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_12209
Solvent DMSO-d6
Source Vendor ID: NMR/10260710; Lab Info: AU; Lab Number: AU-0000037