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4-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-(2-furyl)-4H-1,2,4-triazole-3-thiol

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4-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-(2-furyl)-4H-1,2,4-triazole-3-thiol
SpectraBase Compound ID AY3XJzZNs8x
InChI InChI=1S/C14H11N3O3S/c21-14-16-15-13(11-2-1-5-18-11)17(14)9-3-4-10-12(8-9)20-7-6-19-10/h1-5,8H,6-7H2,(H,16,21)
InChIKey PCEBFLJWTODZGD-UHFFFAOYSA-N
Mol Weight 301.32 g/mol
Molecular Formula C14H11N3O3S
Exact Mass 301.052112 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HI5JPSZsWeq
Name 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-(2-furyl)-4H-1,2,4-triazole-3-thiol
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/C14H11N3O3S/c21-14-16-15-13(11-2-1-5-18-11)17(14)9-3-4-10-12(8-9)20-7-6-19-10/h1-5,8H,6-7H2,(H,16,21)
InChIKey PCEBFLJWTODZGD-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_35825
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: E94371; SBI_ID: SBI-035829
Synonyms 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-(2-furyl)-4H-1,2,4-triazol-3-yl hydrosulfide
Temperature 308 °C