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2-N-tert-butyl-6-(2,2,2-trifluoroethoxy)-4-N-[4-(trifluoromethoxy)phenyl]-1,3,5-triazine-2,4-diamine
SpectraBase Compound ID FYQQwmuU4gx
InChI InChI=1S/C16H17F6N5O2/c1-14(2,3)27-12-24-11(25-13(26-12)28-8-15(17,18)19)23-9-4-6-10(7-5-9)29-16(20,21)22/h4-7H,8H2,1-3H3,(H2,23,24,25,26,27)
InChIKey CCEDMRHMBZALRO-UHFFFAOYSA-N
Mol Weight 425.34 g/mol
Molecular Formula C16H17F6N5O2
Exact Mass 425.128644 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3urq95dVtPq
Name 1,3,5-triazine-2,4-diamine, N~2~-(1,1-dimethylethyl)-6-(2,2,2-trifluoroethoxy)-N~4~-[4-(trifluoromethoxy)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 425.128643783 u
Formula C16H17F6N5O2
InChI InChI=1S/C16H17F6N5O2/c1-14(2,3)27-12-24-11(25-13(26-12)28-8-15(17,18)19)23-9-4-6-10(7-5-9)29-16(20,21)22/h4-7H,8H2,1-3H3,(H2,23,24,25,26,27)
InChIKey CCEDMRHMBZALRO-UHFFFAOYSA-N
Molecular Weight 425.335 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_14570
Solvent DMSO-d6
Source Vendor ID: NMR/10320141; Lab Info: AS; Lab Number: AS-X000053