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2-Carboxy-4-methoxy-5-(methoxycarbonyl)-1-methylpyrrole
SpectraBase Compound ID 5G9KxhFlbxg
InChI InChI=1S/C9H11NO5/c1-10-5(8(11)12)4-6(14-2)7(10)9(13)15-3/h4H,1-3H3,(H,11,12)
InChIKey MKEOVVBJUBNVDD-UHFFFAOYSA-N
Mol Weight 213.19 g/mol
Molecular Formula C9H11NO5
Exact Mass 213.063722 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1A9YcFvcpEY
Name 2-Carboxy-4-methoxy-5-(methoxycarbonyl)-1-methylpyrrole
Alternate Name(s) 4-Methoxy-5-(methoxycarbonyl)-1-methyl-1H-pyrrole-2-carboxylic acid
CAS Registry Number 136629-83-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H11NO5
InChI InChI=1S/C9H11NO5/c1-10-5(8(11)12)4-6(14-2)7(10)9(13)15-3/h4H,1-3H3,(H,11,12)
InChIKey MKEOVVBJUBNVDD-UHFFFAOYSA-N
Molecular Weight 213.189 g/mol
SMILES OC(c1[n](c(c(OC)c1)C(=O)OC)C)=O
SPLASH splash10-03yi-2960000000-20c4acf60ac173727774
Source of Spectrum J-56-6943-9
Wiley ID 1212379