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2-Amino-6-methyl-4,4-bis(trifluoromethyl)-1-[4-(trifluoromethyl)phenyl]-1,4-dihydro-3-pyridinecarbonitrile
SpectraBase Compound ID BVG38N9VyPw
InChI InChI=1S/C16H10F9N3/c1-8-6-13(15(20,21)22,16(23,24)25)11(7-26)12(27)28(8)10-4-2-9(3-5-10)14(17,18)19/h2-6H,27H2,1H3
InChIKey CLZGNEYEWJEQNO-UHFFFAOYSA-N
Mol Weight 415.26 g/mol
Molecular Formula C16H10F9N3
Exact Mass 415.073101 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8LBwj4nhDgo
Name 3-pyridinecarbonitrile, 2-amino-1,4-dihydro-6-methyl-4,4-bis(trifluoromethyl)-1-[4-(trifluoromethyl)phenyl]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 415.073100801 u
Formula C16H10F9N3
InChI InChI=1S/C16H10F9N3/c1-8-6-13(15(20,21)22,16(23,24)25)11(7-26)12(27)28(8)10-4-2-9(3-5-10)14(17,18)19/h2-6H,27H2,1H3
InChIKey CLZGNEYEWJEQNO-UHFFFAOYSA-N
Molecular Weight 415.263 g/mol
NMR Offset 15.0036
NMR Spectrometer Frequency 250.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_2715
Solvent DMSO-d6
Source Vendor ID: NMR/9243356; Lab Info: AU; Lab Number: AU-0000796
Temperature 23.85 °C