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1,3,5-triazine-2,4-diamine, N~2~-butyl-N~4~-[2-(tricyclo[3.3.1.1~3,7~]dec-1-yloxy)ethyl]-6-(2,2,2-trifluoroethoxy)-
SpectraBase Compound ID LEgpwHYNfLB
InChI InChI=1S/C21H32F3N5O2/c1-2-3-4-25-17-27-18(29-19(28-17)30-13-21(22,23)24)26-5-6-31-20-10-14-7-15(11-20)9-16(8-14)12-20/h14-16H,2-13H2,1H3,(H2,25,26,27,28,29)/t14-,15+,16-,20-
InChIKey LYZPFRGAMVFMKR-BMWJPVITSA-N
Mol Weight 443.5 g/mol
Molecular Formula C21H32F3N5O2
Exact Mass 443.25081 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID E8ujmNeHLlM
Name 1,3,5-triazine-2,4-diamine, N~2~-butyl-N~4~-[2-(tricyclo[3.3.1.1~3,7~]dec-1-yloxy)ethyl]-6-(2,2,2-trifluoroethoxy)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 443.250809777 u
Formula C21H32F3N5O2
InChI InChI=1S/C21H32F3N5O2/c1-2-3-4-25-17-27-18(29-19(28-17)30-13-21(22,23)24)26-5-6-31-20-10-14-7-15(11-20)9-16(8-14)12-20/h14-16H,2-13H2,1H3,(H2,25,26,27,28,29)/t14-,15+,16-,20-
InChIKey LYZPFRGAMVFMKR-BMWJPVITSA-N
Molecular Weight 443.515 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_16774
Solvent DMSO-d6
Source Vendor ID: NMR/11260437; Lab Info: AS; Lab Number: AS-X000113