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3-[(2,3-dihydro-1,4-benzodioxin-6-ylamino)carbonyl]-1-methyl-1H-pyrazole-5-carboxylic acid
SpectraBase Compound ID CkWFxvhxlY9
InChI InChI=1S/C14H13N3O5/c1-17-10(14(19)20)7-9(16-17)13(18)15-8-2-3-11-12(6-8)22-5-4-21-11/h2-3,6-7H,4-5H2,1H3,(H,15,18)(H,19,20)
InChIKey JSPPWDNAGCEJFZ-UHFFFAOYSA-N
Mol Weight 303.27 g/mol
Molecular Formula C14H13N3O5
Exact Mass 303.085521 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9TVWwpF2QIt
Name 3-[(2,3-dihydro-1,4-benzodioxin-6-ylamino)carbonyl]-1-methyl-1H-pyrazole-5-carboxylic acid
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/C14H13N3O5/c1-17-10(14(19)20)7-9(16-17)13(18)15-8-2-3-11-12(6-8)22-5-4-21-11/h2-3,6-7H,4-5H2,1H3,(H,15,18)(H,19,20)
InChIKey JSPPWDNAGCEJFZ-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_34667
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: 9139688; SBI_ID: SBI-034671
Temperature 306 °C