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1H-Pyrrole-3-propanoic acid, 5-(ethoxycarbonyl)-1-(hydroxymethyl)-2,4-dimethyl-, methyl ester
SpectraBase Compound ID JEywMxDHVF9
InChI InChI=1S/C14H21NO5/c1-5-20-14(18)13-9(2)11(6-7-12(17)19-4)10(3)15(13)8-16/h16H,5-8H2,1-4H3
InChIKey MRNBLXDMMAKQAC-UHFFFAOYSA-N
Mol Weight 283.32 g/mol
Molecular Formula C14H21NO5
Exact Mass 283.141973 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7UqfLm7UY5c
Name 1H-Pyrrole-3-propanoic acid, 5-(ethoxycarbonyl)-1-(hydroxymethyl)-2,4-dimethyl-, methyl ester
CAS Registry Number 122676-34-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H21NO5
InChI InChI=1S/C14H21NO5/c1-5-20-14(18)13-9(2)11(6-7-12(17)19-4)10(3)15(13)8-16/h16H,5-8H2,1-4H3
InChIKey MRNBLXDMMAKQAC-UHFFFAOYSA-N
Molecular Weight 283.324 g/mol
SMILES OC[n]1c(c(C)c(c1C)CCC(=O)OC)C(=O)OCC
SPLASH splash10-0f89-0960000000-ee219e8fd58be4c60868
Source of Spectrum J-54-4805-16
Synonyms Ethyl 1-(hydroxymethyl)-4-(3-methoxy-3-oxopropyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate Ethyl 1-(hydroxymethyl)-4-[2-(methoxycarbonyl)-ethyl]-3,5-dimethylpyrrile-2-carboxylate
Wiley ID 1286841