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2-chloro-10-[(4H-1,2,4-triazol-3-ylsulfanyl)acetyl]-10H-phenothiazine
SpectraBase Compound ID J9jKcU1iHlX
InChI InChI=1S/C16H11ClN4OS2/c17-10-5-6-14-12(7-10)21(11-3-1-2-4-13(11)24-14)15(22)8-23-16-18-9-19-20-16/h1-7,9H,8H2,(H,18,19,20)
InChIKey NXCVLSSRHZFJHI-UHFFFAOYSA-N
Mol Weight 374.86 g/mol
Molecular Formula C16H11ClN4OS2
Exact Mass 374.006281 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 85gApTUmXCP
Name 2-chloro-10-[(4H-1,2,4-triazol-3-ylsulfanyl)acetyl]-10H-phenothiazine
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/C16H11ClN4OS2/c17-10-5-6-14-12(7-10)21(11-3-1-2-4-13(11)24-14)15(22)8-23-16-18-9-19-20-16/h1-7,9H,8H2,(H,18,19,20)
InChIKey NXCVLSSRHZFJHI-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_6521
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: D15640; Labnumber: VGU-17509; SBI_ID: SBI-006524
Synonyms 2-(2-chloro-10H-phenothiazin-10-yl)-2-oxoethyl 4H-1,2,4-triazol-3-yl sulfide
Temperature 308 °C