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carbamic acid, [1-[(2,3-dihydro-1,5-dimethyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)amino]-2,2,2-trifluoro-1-(trifluoromethyl)ethyl]-, ethyl ester

View entire compound with spectra: 1 NMR

carbamic acid, [1-[(2,3-dihydro-1,5-dimethyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)amino]-2,2,2-trifluoro-1-(trifluoromethyl)ethyl]-, ethyl ester
SpectraBase Compound ID 9lk0j37BLmb
InChI InChI=1S/C17H18F6N4O3/c1-4-30-14(29)25-15(16(18,19)20,17(21,22)23)24-12-10(2)26(3)27(13(12)28)11-8-6-5-7-9-11/h5-9,24H,4H2,1-3H3,(H,25,29)
InChIKey PGVCEFHAUBOVNQ-UHFFFAOYSA-N
Mol Weight 440.35 g/mol
Molecular Formula C17H18F6N4O3
Exact Mass 440.128309 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID RXPl8Pec2N
Name carbamic acid, [1-[(2,3-dihydro-1,5-dimethyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)amino]-2,2,2-trifluoro-1-(trifluoromethyl)ethyl]-, ethyl 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 440.128309431 u
Formula C17H18F6N4O3
InChI InChI=1S/C17H18F6N4O3/c1-4-30-14(29)25-15(16(18,19)20,17(21,22)23)24-12-10(2)26(3)27(13(12)28)11-8-6-5-7-9-11/h5-9,24H,4H2,1-3H3,(H,25,29)
InChIKey PGVCEFHAUBOVNQ-UHFFFAOYSA-N
Molecular Weight 440.346 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_7782
Solvent DMSO-d6
Source Vendor ID: NMR/10231192; Lab Info: AU; Lab Number: AU-t000957
Temperature 23.85 °C