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6-(4-nitrophenyl)-3-propyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
SpectraBase Compound ID 63CDI2c9ADX
InChI InChI=1S/C12H11N5O2S/c1-2-3-10-13-14-12-16(10)15-11(20-12)8-4-6-9(7-5-8)17(18)19/h4-7H,2-3H2,1H3
InChIKey YCCRORPBQSYZTH-UHFFFAOYSA-N
Mol Weight 289.31 g/mol
Molecular Formula C12H11N5O2S
Exact Mass 289.063346 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 91jXOaqK19Y
Name 6-(4-nitrophenyl)-3-propyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C12H11N5O2S/c1-2-3-10-13-14-12-16(10)15-11(20-12)8-4-6-9(7-5-8)17(18)19/h4-7H,2-3H2,1H3
InChIKey YCCRORPBQSYZTH-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_35450
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: E91024; SBI_ID: SBI-035454
Temperature 308 °C