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1,3,5-triazin-2-amine, 4-[[[1-(3-chloro-4-fluorophenyl)-1H-tetrazol-5-yl]thio]methyl]-6-(4-morpholinyl)-
SpectraBase Compound ID 2uZQAFnGdxM
InChI InChI=1S/C15H15ClFN9OS/c16-10-7-9(1-2-11(10)17)26-15(22-23-24-26)28-8-12-19-13(18)21-14(20-12)25-3-5-27-6-4-25/h1-2,7H,3-6,8H2,(H2,18,19,20,21)
InChIKey ICSLBCOLLJIKBY-UHFFFAOYSA-N
Mol Weight 423.86 g/mol
Molecular Formula C15H15ClFN9OS
Exact Mass 423.079283 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6txgD81ZldL
Name 1,3,5-triazin-2-amine, 4-[[[1-(3-chloro-4-fluorophenyl)-1H-tetrazol-5-yl]thio]methyl]-6-(4-morpholinyl)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 423.079283175 u
Formula C15H15ClFN9OS
InChI InChI=1S/C15H15ClFN9OS/c16-10-7-9(1-2-11(10)17)26-15(22-23-24-26)28-8-12-19-13(18)21-14(20-12)25-3-5-27-6-4-25/h1-2,7H,3-6,8H2,(H2,18,19,20,21)
InChIKey ICSLBCOLLJIKBY-UHFFFAOYSA-N
Molecular Weight 423.858 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_11781
Solvent DMSO-d6
Source Vendor ID: ZI/10028669; Lab Info: SAD; Lab Number: SAD-EXC0010