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([1,2,4]triazolo[3,4-b][1,3]benzothiazol-3-ylsulfanyl)acetonitrile
SpectraBase Compound ID 4pktj0dwZGn
InChI InChI=1S/C10H6N4S2/c11-5-6-15-9-12-13-10-14(9)7-3-1-2-4-8(7)16-10/h1-4H,6H2
InChIKey VDGVMUHNHFFAOC-UHFFFAOYSA-N
Mol Weight 246.31 g/mol
Molecular Formula C10H6N4S2
Exact Mass 246.003389 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Ff6aBsWJhVk
Name ([1,2,4]triazolo[3,4-b][1,3]benzothiazol-3-ylsulfanyl)acetonitrile
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 246.003388557 u
Formula C10H6N4S2
InChI InChI=1S/C10H6N4S2/c11-5-6-15-9-12-13-10-14(9)7-3-1-2-4-8(7)16-10/h1-4H,6H2
InChIKey VDGVMUHNHFFAOC-UHFFFAOYSA-N
Molecular Weight 246.306 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_4102
Solvent DMSO-d6
Source Vendor ID: NMR/12230702; Lab Info: KND; Lab Number: KND-112N0053