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1H-1,2,4-triazole-5-thiol, 3-(4,7-dimethoxy-1,3-benzodioxol-5-yl)-

View entire compound with spectra: 1 NMR

1H-1,2,4-triazole-5-thiol, 3-(4,7-dimethoxy-1,3-benzodioxol-5-yl)-
SpectraBase Compound ID 4L5etjFoMH2
InChI InChI=1S/C11H11N3O4S/c1-15-6-3-5(10-12-11(19)14-13-10)7(16-2)9-8(6)17-4-18-9/h3H,4H2,1-2H3,(H2,12,13,14,19)
InChIKey ZYERYYFZJBCXGQ-UHFFFAOYSA-N
Mol Weight 281.29 g/mol
Molecular Formula C11H11N3O4S
Exact Mass 281.047027 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FYznh4OrNKw
Name 1H-1,2,4-triazole-5-thiol, 3-(4,7-dimethoxy-1,3-benzodioxol-5-yl)-
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/C11H11N3O4S/c1-15-6-3-5(10-12-11(19)14-13-10)7(16-2)9-8(6)17-4-18-9/h3H,4H2,1-2H3,(H2,12,13,14,19)
InChIKey ZYERYYFZJBCXGQ-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_7529_6241
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: NMR/18247672; Labnumber: DUT-1006008