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Ethyl 4-Acetyl-1-benzylpyrrole-2-carboxylate
SpectraBase Compound ID 5KCE13oeLlM
InChI InChI=1S/C16H17NO3/c1-3-20-16(19)15-9-14(12(2)18)11-17(15)10-13-7-5-4-6-8-13/h4-9,11H,3,10H2,1-2H3
InChIKey FACBOJHJUYLRDB-UHFFFAOYSA-N
Mol Weight 271.32 g/mol
Molecular Formula C16H17NO3
Exact Mass 271.120843 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2OKzw4nqYSD
Name Ethyl 4-Acetyl-1-benzylpyrrole-2-carboxylate
Alternate Name(s) 4-acetyl-1-(phenylmethyl)-2-pyrrolecarboxylic acid ethyl ester ethyl 4-acetyl-1-benzyl-pyrrole-2-carboxylate ethyl 4-ethanoyl-1-(phenylmethyl)pyrrole-2-carboxylate
Comments Less than 3 mono-isotopic peaks
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Formula C16H17NO3
InChI InChI=1S/C16H17NO3/c1-3-20-16(19)15-9-14(12(2)18)11-17(15)10-13-7-5-4-6-8-13/h4-9,11H,3,10H2,1-2H3
InChIKey FACBOJHJUYLRDB-UHFFFAOYSA-N
Molecular Weight 271.316 g/mol
SMILES c1([n](cc(c1)C(=O)C)Cc1ccccc1)C(=O)OCC
SPLASH splash10-0006-0090000000-91a811083ee7942ce4a4
Source of Spectrum E1-44-52-8
Wiley ID 1553247