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4-(2-Ethoxycarbonylpyrrol-4-yl)butyric acid

View entire compound with spectra: 1 MS (GC)

4-(2-Ethoxycarbonylpyrrol-4-yl)butyric acid
SpectraBase Compound ID 2uiNdE2M4kH
InChI InChI=1S/C11H15NO4/c1-2-16-11(15)9-6-8(7-12-9)4-3-5-10(13)14/h6-7,12H,2-5H2,1H3,(H,13,14)
InChIKey ZLUXTLMRWGOZNG-UHFFFAOYSA-N
Mol Weight 225.24 g/mol
Molecular Formula C11H15NO4
Exact Mass 225.100108 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3pD2BaK8NIw
Name 4-(2-Ethoxycarbonylpyrrol-4-yl)butyric acid
Alternate Name(s) 4-[5-(ethoxycarbonyl)-1H-pyrrol-3-yl]butanoic acid 4-(5-ethoxycarbonyl-1H-pyrrol-3-yl)butanoic acid
Comments Less than 3 mono-isotopic peaks
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Formula C11H15NO4
InChI InChI=1S/C11H15NO4/c1-2-16-11(15)9-6-8(7-12-9)4-3-5-10(13)14/h6-7,12H,2-5H2,1H3,(H,13,14)
InChIKey ZLUXTLMRWGOZNG-UHFFFAOYSA-N
Molecular Weight 225.244 g/mol
SMILES [nH]1cc(CCCC(=O)O)cc1C(=O)OCC
SPLASH splash10-0ufr-0980000000-de33558799f94caa3ec0
Source of Spectrum E1-44-58-5
Wiley ID 1553233