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1-Benzyl-5-methylsulfanyl-3-nitro-1H-[1,2,4]triazole
SpectraBase Compound ID EXzMiftRRKb
InChI InChI=1S/C10H10N4O2S/c1-17-10-11-9(14(15)16)12-13(10)7-8-5-3-2-4-6-8/h2-6H,7H2,1H3
InChIKey UPKGGHMVZOXJTC-UHFFFAOYSA-N
Mol Weight 250.28 g/mol
Molecular Formula C10H10N4O2S
Exact Mass 250.052447 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7ZvkF2DN3oZ
Name 1H-1,2,4-triazole, 5-(methylthio)-3-nitro-1-(phenylmethyl)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 250.052446750 u
Formula C10H10N4O2S
InChI InChI=1S/C10H10N4O2S/c1-17-10-11-9(14(15)16)12-13(10)7-8-5-3-2-4-6-8/h2-6H,7H2,1H3
InChIKey UPKGGHMVZOXJTC-UHFFFAOYSA-N
Molecular Weight 250.276 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_12129
Solvent DMSO-d6
Source Vendor ID: NMR/10271970; Lab Info: LP; Lab Number: LP-3103255