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7-(4-bromophenyl)-5-[5-chloro-2-(difluoromethoxy)phenyl]-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine
SpectraBase Compound ID G7IVWeZToG2
InChI InChI=1S/C18H12BrClF2N4O/c19-11-3-1-10(2-4-11)15-8-14(25-18-23-9-24-26(15)18)13-7-12(20)5-6-16(13)27-17(21)22/h1-9,15,17H,(H,23,24,25)
InChIKey KQHDCCTXHAQKFK-UHFFFAOYSA-N
Mol Weight 453.67 g/mol
Molecular Formula C18H12BrClF2N4O
Exact Mass 451.985108 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2eEbfTc5kLi
Name 7-(4-bromophenyl)-5-[5-chloro-2-(difluoromethoxy)phenyl]-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 451.985108047 u
Formula C18H12BrClF2N4O
InChI InChI=1S/C18H12BrClF2N4O/c19-11-3-1-10(2-4-11)15-8-14(25-18-23-9-24-26(15)18)13-7-12(20)5-6-16(13)27-17(21)22/h1-9,15,17H,(H,23,24,25)
InChIKey KQHDCCTXHAQKFK-UHFFFAOYSA-N
Molecular Weight 453.675 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_7320
Solvent DMSO-d6
Source Vendor ID: NMR/13218082