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1H-Pyrrole-2-carboxylic acid, 4-(2-carboxybenzoyl)-, 2-ethyl ester
SpectraBase Compound ID EInXoMTI5iq
InChI InChI=1S/C15H13NO5/c1-2-21-15(20)11-6-4-3-5-10(11)13(17)9-7-12(14(18)19)16-8-9/h3-8,16H,2H2,1H3,(H,18,19)
InChIKey FUZBPGQDDNSLJN-UHFFFAOYSA-N
Mol Weight 287.27 g/mol
Molecular Formula C15H13NO5
Exact Mass 287.079373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CWWSE1g96Bg
Name 1H-Pyrrole-2-carboxylic acid, 4-(2-carboxybenzoyl)-, 2-ethyl ester
Alternate Name(s) 2-[(5-ethoxycarbonylpyrrol-3-yl)carbonyl]benzoic acid 4-[2-(ethoxycarbonyl)benzoyl]-1H-pyrrole-2-carboxylic acid
CAS Registry Number 121045-58-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H13NO5
InChI InChI=1S/C15H13NO5/c1-2-21-15(20)11-6-4-3-5-10(11)13(17)9-7-12(14(18)19)16-8-9/h3-8,16H,2H2,1H3,(H,18,19)
InChIKey FUZBPGQDDNSLJN-UHFFFAOYSA-N
Molecular Weight 287.271 g/mol
SMILES OC(c1cc(c[nH]1)C(c1c(C(=O)OCC)cccc1)=O)=O
SPLASH splash10-00xr-0920000000-23bcfdcdaa4a0b2f7e5a
Source of Spectrum KC-1988-3009-14
Wiley ID 1290744