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1-{[(1-benzyl-1H-tetraazol-5-yl)sulfanyl]acetyl}-4-phenylpiperazine
SpectraBase Compound ID 5hIyU3qJ8Eg
InChI InChI=1S/C20H22N6OS/c27-19(25-13-11-24(12-14-25)18-9-5-2-6-10-18)16-28-20-21-22-23-26(20)15-17-7-3-1-4-8-17/h1-10H,11-16H2
InChIKey FJNWPGOCCNOSDO-UHFFFAOYSA-N
Mol Weight 394.5 g/mol
Molecular Formula C20H22N6OS
Exact Mass 394.157581 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AQ1XhhDeiEh
Name 1-{[(1-benzyl-1H-tetraazol-5-yl)sulfanyl]acetyl}-4-phenylpiperazine
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/C20H22N6OS/c27-19(25-13-11-24(12-14-25)18-9-5-2-6-10-18)16-28-20-21-22-23-26(20)15-17-7-3-1-4-8-17/h1-10H,11-16H2
InChIKey FJNWPGOCCNOSDO-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_9414
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: D46410; Labnumber: SPKOL-3899; SBI_ID: SBI-009417
Synonyms 1-benzyl-1H-tetraazol-5-yl 2-oxo-2-(4-phenyl-1-piperazinyl)ethyl sulfide
Temperature 318 °C