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2-(2-formyl-5-methylol-pyrrol-1-yl)acetic acid
SpectraBase Compound ID 5ifK6FZ2Prp
InChI InChI=1S/C8H9NO4/c10-4-6-1-2-7(5-11)9(6)3-8(12)13/h1-2,4,11H,3,5H2,(H,12,13)
InChIKey GTVLCDCJGZIGPM-UHFFFAOYSA-N
Mol Weight 183.16 g/mol
Molecular Formula C8H9NO4
Exact Mass 183.053158 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7RbSuQkgvIk
Name 2-(2-formyl-5-methylol-pyrrol-1-yl)acetic acid
CAS Registry Number 63723-31-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H9NO4
InChI InChI=1S/C8H9NO4/c10-4-6-1-2-7(5-11)9(6)3-8(12)13/h1-2,4,11H,3,5H2,(H,12,13)
InChIKey GTVLCDCJGZIGPM-UHFFFAOYSA-N
Molecular Weight 183.163 g/mol
SMILES OCc1ccc([n]1CC(=O)O)C=O
SPLASH splash10-1003-9600000000-05c3d3d938abd388d8d3
Source of Spectrum SB-32-254-0
Synonyms 2-[2-(hydroxymethyl)-5-methanoyl-pyrrol-1-yl]ethanoic acid 2-[2-formyl-5-(hydroxymethyl)-1-pyrrolyl]acetic acid 2-[2-formyl-5-(hydroxymethyl)pyrrol-1-yl]acetic acid
Wiley ID 1179539