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4H-1,2,4-triazol-4-amine, 3,5-bis[(2-benzoxazolylthio)methyl]-
SpectraBase Compound ID IYeD3QJQtCk
InChI InChI=1S/C18H14N6O2S2/c19-24-15(9-27-17-20-11-5-1-3-7-13(11)25-17)22-23-16(24)10-28-18-21-12-6-2-4-8-14(12)26-18/h1-8H,9-10,19H2
InChIKey RFFVXUAVIRSHNV-UHFFFAOYSA-N
Mol Weight 410.47 g/mol
Molecular Formula C18H14N6O2S2
Exact Mass 410.061966 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3hcvpqdr8cY
Name 4H-1,2,4-triazol-4-amine, 3,5-bis[(2-benzoxazolylthio)methyl]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 410.061966061 u
Formula C18H14N6O2S2
InChI InChI=1S/C18H14N6O2S2/c19-24-15(9-27-17-20-11-5-1-3-7-13(11)25-17)22-23-16(24)10-28-18-21-12-6-2-4-8-14(12)26-18/h1-8H,9-10,19H2
InChIKey RFFVXUAVIRSHNV-UHFFFAOYSA-N
Molecular Weight 410.470 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_18439
Solvent DMSO-d6
Source Vendor ID: NMR/11280471; Lab Info: L-42,Shitov; Lab Number: L-42/1050001