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4-cyano-3,5-dimethyl-1H-pyrrole-2-carboxylic acid

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4-cyano-3,5-dimethyl-1H-pyrrole-2-carboxylic acid
SpectraBase Compound ID D7PmPi6RQF4
InChI InChI=1S/C8H8N2O2/c1-4-6(3-9)5(2)10-7(4)8(11)12/h10H,1-2H3,(H,11,12)
InChIKey MXRLDGFCXONJMS-UHFFFAOYSA-N
Mol Weight 164.16 g/mol
Molecular Formula C8H8N2O2
Exact Mass 164.058578 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7rWfbLbh1Ru
Name 4-cyano-3,5-dimethyl-1H-pyrrole-2-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/C8H8N2O2/c1-4-6(3-9)5(2)10-7(4)8(11)12/h10H,1-2H3,(H,11,12)
InChIKey MXRLDGFCXONJMS-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_10690
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: 135570; Labnumber: TOKS-2062; VK_ID: VK-010694
Temperature 318 °C