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2,4-dimethyl-5-formyl-1H-pyrrole-3-carboxylic acid
SpectraBase Compound ID 1mi9Z38NBFn
InChI InChI=1S/C8H9NO3/c1-4-6(3-10)9-5(2)7(4)8(11)12/h3,9H,1-2H3,(H,11,12)
InChIKey YCIHQDVIAISDPS-UHFFFAOYSA-N
Mol Weight 167.16 g/mol
Molecular Formula C8H9NO3
Exact Mass 167.058243 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Cke1zTUl4jz
Name 2,4-dimethyl-5-formyl-1H-pyrrole-3-carboxylic acid
Appearance Yellow solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H9NO3
InChI InChI=1S/C8H9NO3/c1-4-6(3-10)9-5(2)7(4)8(11)12/h3,9H,1-2H3,(H,11,12)
InChIKey YCIHQDVIAISDPS-UHFFFAOYSA-N
Ionization Type EI
Molecular Weight 167.164 g/mol
SMILES [nH]1c(c(c(C(=O)O)c1C)C)C=O
SPLASH splash10-01b9-0900000000-536c75cf2bbe48a22dc4
Source of Spectrum CN103992308A
Wiley ID 1849730