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3-[(Ethoxycarbonyl)methyl]-1-methylpyrrole
SpectraBase Compound ID 4esofVOV2Tb
InChI InChI=1S/C9H13NO2/c1-3-12-9(11)6-8-4-5-10(2)7-8/h4-5,7H,3,6H2,1-2H3
InChIKey BJGXENPUOCVMRY-UHFFFAOYSA-N
Mol Weight 167.21 g/mol
Molecular Formula C9H13NO2
Exact Mass 167.094629 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5VNBjA1V6GT
Name 3-[(Ethoxycarbonyl)methyl]-1-methylpyrrole
Alternate Name(s) ethyl (1-methyl-1H-pyrrol-3-yl)acetate 2-(1-methyl-3-pyrrolyl)acetic acid ethyl ester ethyl 2-(1-methylpyrrol-3-yl)acetate ethyl 2-(1-methylpyrrol-3-yl)ethanoate
Comments Less than 3 mono-isotopic peaks
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Formula C9H13NO2
InChI InChI=1S/C9H13NO2/c1-3-12-9(11)6-8-4-5-10(2)7-8/h4-5,7H,3,6H2,1-2H3
InChIKey BJGXENPUOCVMRY-UHFFFAOYSA-N
Molecular Weight 167.208 g/mol
SMILES c1[n](ccc1CC(=O)OCC)C
SPLASH splash10-0006-9200000000-e1235974f193f23b227b
Source of Spectrum F-48-4703-5
Wiley ID 1163670