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N-[1-[(Adamantan-1-ylmethyl)-amino]-2,2,2-trifluoro-1-trifluoromethyl-ethyl]-4-chloro-benzamide
SpectraBase Compound ID 7UMi9CCtd9M
InChI InChI=1S/C21H23ClF6N2O/c22-16-3-1-15(2-4-16)17(31)30-19(20(23,24)25,21(26,27)28)29-11-18-8-12-5-13(9-18)7-14(6-12)10-18/h1-4,12-14,29H,5-11H2,(H,30,31)
InChIKey AOLKWKCPLMIMGH-UHFFFAOYSA-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 6BgvIl3Aqkj
Name benzamide, 4-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/c22-16-3-1-15(2-4-16)17(31)30-19(20(23,24)25,21(26,27)28)29-11-18-8-12-5-13(9-18)7-14(6-12)10-18/h1-4,12-14,29H,5-11H2,(H,30,31)
InChIKey AOLKWKCPLMIMGH-UHFFFAOYSA-N
Molecular Weight 468.871 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_15783
Solvent DMSO-d6
Source Vendor ID: NMR/11250272; Lab Info: AU; Lab Number: AU-p000499