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N-[1-[(Adamantan-1-ylmethyl)-amino]-2,2,2-trifluoro-1-trifluoromethyl-ethyl]-3-chloro-benzamide
SpectraBase Compound ID DB46rJzmPC3
InChI InChI=1S/C21H23ClF6N2O/c22-16-3-1-2-15(7-16)17(31)30-19(20(23,24)25,21(26,27)28)29-11-18-8-12-4-13(9-18)6-14(5-12)10-18/h1-3,7,12-14,29H,4-6,8-11H2,(H,30,31)/t12-,13+,14-,18-
InChIKey UBFVUZFVCAEUSC-WXZYKRPKSA-N
Mol Weight 468.87 g/mol
Molecular Formula C21H23ClF6N2O
Exact Mass 468.14031 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FGvXCIi4AeJ
Name benzamide, 3-chloro-N-[2,2,2-trifluoro-1-[(tricyclo[3.3.1.1~3,7~]dec-1-ylmethyl)amino]-1-(trifluoromethyl)ethyl]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 468.140310046 u
Formula C21H23ClF6N2O
InChI InChI=1S/C21H23ClF6N2O/c22-16-3-1-2-15(7-16)17(31)30-19(20(23,24)25,21(26,27)28)29-11-18-8-12-4-13(9-18)6-14(5-12)10-18/h1-3,7,12-14,29H,4-6,8-11H2,(H,30,31)/t12-,13+,14-,18-
InChIKey UBFVUZFVCAEUSC-WXZYKRPKSA-N
Molecular Weight 468.871 g/mol
NMR Offset 17.9883
NMR Spectrometer Frequency 500.132
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_16344
Solvent CDCl3
Source Vendor ID: NMR/11250435; Lab Info: AU; Lab Number: AU-01040027