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1-(difluoromethyl)-4-(4-methylphenyl)-1,4-dihydro-5H-tetraazole-5-thione

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1-(difluoromethyl)-4-(4-methylphenyl)-1,4-dihydro-5H-tetraazole-5-thione
SpectraBase Compound ID 5AZRClhkyk1
InChI InChI=1S/C9H8F2N4S/c1-6-2-4-7(5-3-6)14-9(16)15(8(10)11)13-12-14/h2-5,8H,1H3
InChIKey MRGNUYRFVLKXOA-UHFFFAOYSA-N
Mol Weight 242.25 g/mol
Molecular Formula C9H8F2N4S
Exact Mass 242.043774 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HKo2gcbOgTQ
Name 1-(difluoromethyl)-4-(4-methylphenyl)-1,4-dihydro-5H-tetraazole-5-thione
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/C9H8F2N4S/c1-6-2-4-7(5-3-6)14-9(16)15(8(10)11)13-12-14/h2-5,8H,1H3
InChIKey MRGNUYRFVLKXOA-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_23524
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: D40707; Labnumber: VLM_KP-0069; SBI_ID: SBI-023528
Temperature 318 °C