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N-[2-(1-adamantylmethylamino)-1,1,1,3,3,3-hexafluoropropan-2-yl]-2,4-dichlorobenzamide
SpectraBase Compound ID 207oGwWf8zl
InChI InChI=1S/C21H22Cl2F6N2O/c22-14-1-2-15(16(23)6-14)17(32)31-19(20(24,25)26,21(27,28)29)30-10-18-7-11-3-12(8-18)5-13(4-11)9-18/h1-2,6,11-13,30H,3-5,7-10H2,(H,31,32)/t11-,12+,13-,18-
InChIKey SSEHXLYWCJZVEL-MCXHQAMOSA-N
Mol Weight 503.32 g/mol
Molecular Formula C21H22Cl2F6N2O
Exact Mass 502.101338 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JeD1rlCPtC5
Name benzamide, 2,4-dichloro-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 502.101337713 u
Formula C21H22Cl2F6N2O
InChI InChI=1S/C21H22Cl2F6N2O/c22-14-1-2-15(16(23)6-14)17(32)31-19(20(24,25)26,21(27,28)29)30-10-18-7-11-3-12(8-18)5-13(4-11)9-18/h1-2,6,11-13,30H,3-5,7-10H2,(H,31,32)/t11-,12+,13-,18-
InChIKey SSEHXLYWCJZVEL-MCXHQAMOSA-N
Molecular Weight 503.316 g/mol
NMR Offset 17.9885
NMR Spectrometer Frequency 500.132
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_16347
Solvent CDCl3
Source Vendor ID: NMR/11250438; Lab Info: AU; Lab Number: AU-01040030