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N-(1,3-benzodioxol-5-ylmethyl)-1H-1,2,4-triazole-3-carboxamide

View entire compound with spectra: 1 NMR, and 1 MS (GC)

N-(1,3-benzodioxol-5-ylmethyl)-1H-1,2,4-triazole-3-carboxamide
SpectraBase Compound ID 9ptI9gPm8Lr
InChI InChI=1S/C11H10N4O3/c16-11(10-13-5-14-15-10)12-4-7-1-2-8-9(3-7)18-6-17-8/h1-3,5H,4,6H2,(H,12,16)(H,13,14,15)
InChIKey CXRXVWUHOANKIH-UHFFFAOYSA-N
Mol Weight 246.23 g/mol
Molecular Formula C11H10N4O3
Exact Mass 246.07529 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5wt63EJWm2h
Name N-(1,3-benzodioxol-5-ylmethyl)-1H-1,2,4-triazole-3-carboxamide
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/C11H10N4O3/c16-11(10-13-5-14-15-10)12-4-7-1-2-8-9(3-7)18-6-17-8/h1-3,5H,4,6H2,(H,12,16)(H,13,14,15)
InChIKey CXRXVWUHOANKIH-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_7000_6580
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/11261438; Labnumber: LP-2111087; IOH_ID: IOH-006581