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1,3-benzothiazol-2-yl (4-nitro-1H-pyrazol-1-yl)methyl sulfide
SpectraBase Compound ID KayrSwHQhHs
InChI InChI=1S/C11H8N4O2S2/c16-15(17)8-5-12-14(6-8)7-18-11-13-9-3-1-2-4-10(9)19-11/h1-6H,7H2
InChIKey DILMIZUKHVAQKY-UHFFFAOYSA-N
Mol Weight 292.33 g/mol
Molecular Formula C11H8N4O2S2
Exact Mass 292.008868 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7qSBkCumaAC
Name 1,3-benzothiazol-2-yl (4-nitro-1H-pyrazol-1-yl)methyl sulfide
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/C11H8N4O2S2/c16-15(17)8-5-12-14(6-8)7-18-11-13-9-3-1-2-4-10(9)19-11/h1-6H,7H2
InChIKey DILMIZUKHVAQKY-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_18263
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: UZI/1038761; Labnumber: TRZ-MECL/019370; UZI_ID: UZI-018270
Synonyms 2-{[(4-nitro-1H-pyrazol-1-yl)methyl]sulfanyl}-1,3-benzothiazole
Temperature 318 °C