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1H-Pyrrole-2,5-dicarboxylic acid, 3-(2-methoxy-2-oxoethyl)-4-(3-methoxy-3-oxopropyl)-, 2-(1,1-dimethylethyl) ester
SpectraBase Compound ID 1N24OhTvZYu
InChI InChI=1S/C17H23NO8/c1-17(2,3)26-16(23)14-10(8-12(20)25-5)9(6-7-11(19)24-4)13(18-14)15(21)22/h18H,6-8H2,1-5H3,(H,21,22)
InChIKey XFKTYGFGEKQBJI-UHFFFAOYSA-N
Mol Weight 369.37 g/mol
Molecular Formula C17H23NO8
Exact Mass 369.142367 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6peD3vUpHvj
Name 1H-Pyrrole-2,5-dicarboxylic acid, 3-(2-methoxy-2-oxoethyl)-4-(3-methoxy-3-oxopropyl)-, 2-(1,1-dimethylethyl) ester
CAS Registry Number 84315-31-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H23NO8
InChI InChI=1S/C17H23NO8/c1-17(2,3)26-16(23)14-10(8-12(20)25-5)9(6-7-11(19)24-4)13(18-14)15(21)22/h18H,6-8H2,1-5H3,(H,21,22)
InChIKey XFKTYGFGEKQBJI-UHFFFAOYSA-N
Molecular Weight 369.370 g/mol
SMILES [nH]1c(c(c(c1C(=O)O)CCC(=O)OC)CC(=O)OC)C(OC(C)(C)C)=O
SPLASH splash10-0ue9-0091000000-d7b1d26d854f5db758b8
Source of Spectrum KC-1982-2421-0
Synonyms 5-(tert-butoxycarbonyl)-4-(2-methoxy-2-oxoethyl)-3-(3-methoxy-3-oxopropyl)-1H-pyrrole-2-carboxylic acid 5-t-butoxycarbonyl-3-(2-methoxycarbonylethyl)-4-methoxy-carbonylmethylpyrrole-2-carboxylic acid
Wiley ID 1353556