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alanine, N-(4-chlorobenzoyl)-3,3,3-trifluoro-2-[2-(2-methylphenyl)hydrazino]-, methyl ester
SpectraBase Compound ID Y6teZIQoQv
InChI InChI=1S/C18H17ClF3N3O3/c1-11-5-3-4-6-14(11)24-25-17(16(27)28-2,18(20,21)22)23-15(26)12-7-9-13(19)10-8-12/h3-10,24-25H,1-2H3,(H,23,26)
InChIKey KVIQAPISJMXGAN-UHFFFAOYSA-N
Mol Weight 415.8 g/mol
Molecular Formula C18H17ClF3N3O3
Exact Mass 415.091054 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3NidYAjPwyL
Name alanine, N-(4-chlorobenzoyl)-3,3,3-trifluoro-2-[2-(2-methylphenyl)hydrazino]-, 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 415.091053605 u
Formula C18H17ClF3N3O3
InChI InChI=1S/C18H17ClF3N3O3/c1-11-5-3-4-6-14(11)24-25-17(16(27)28-2,18(20,21)22)23-15(26)12-7-9-13(19)10-8-12/h3-10,24-25H,1-2H3,(H,23,26)
InChIKey KVIQAPISJMXGAN-UHFFFAOYSA-N
Molecular Weight 415.800 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_13060
Solvent DMSO-d6
Source Vendor ID: NMR/10301030; Lab Info: AU; Lab Number: AU-Z000445