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1H-pyrazole, 3-(1,3-benzodioxol-5-yl)-, monohydrochloride

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1H-pyrazole, 3-(1,3-benzodioxol-5-yl)-, monohydrochloride
SpectraBase Compound ID 1BJ5TGE4s4n
InChI InChI=1S/C10H8N2O2.ClH/c1-2-9-10(14-6-13-9)5-7(1)8-3-4-11-12-8;/h1-5H,6H2,(H,11,12);1H
InChIKey APDBMFVFQSCWIE-UHFFFAOYSA-N
Mol Weight 224.65 g/mol
Molecular Formula C10H9ClN2O2
Exact Mass 224.035255 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3rd2aiN7IoK
Name 1H-pyrazole, 3-(1,3-benzodioxol-5-yl)-, monohydrochloride
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/C10H8N2O2.ClH/c1-2-9-10(14-6-13-9)5-7(1)8-3-4-11-12-8;/h1-5H,6H2,(H,11,12);1H
InChIKey APDBMFVFQSCWIE-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_7529_7161
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/18301169; Labnumber: vgyb0003239