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Ethyl 1-benzylpyrrole-3-carboxylate
SpectraBase Compound ID LDsjqFyQFin
InChI InChI=1S/C14H15NO2/c1-2-17-14(16)13-8-9-15(11-13)10-12-6-4-3-5-7-12/h3-9,11H,2,10H2,1H3
InChIKey KSZAVNAKDOXZGJ-UHFFFAOYSA-N
Mol Weight 229.28 g/mol
Molecular Formula C14H15NO2
Exact Mass 229.110279 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IbnVBetf9jk
Name Ethyl 1-benzylpyrrole-3-carboxylate
Alternate Name(s) 1-(phenylmethyl)-3-pyrrolecarboxylic acid ethyl ester 1-benzylpyrrole-3-carboxylic acid ethyl ester ethyl 1-(phenylmethyl)pyrrole-3-carboxylate
Comments Less than 3 mono-isotopic peaks
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Formula C14H15NO2
InChI InChI=1S/C14H15NO2/c1-2-17-14(16)13-8-9-15(11-13)10-12-6-4-3-5-7-12/h3-9,11H,2,10H2,1H3
InChIKey KSZAVNAKDOXZGJ-UHFFFAOYSA-N
Molecular Weight 229.279 g/mol
SMILES c1(c[n](Cc2ccccc2)cc1)C(=O)OCC
SPLASH splash10-016r-9060000000-5e002e0c1d67cfa3afac
Source of Spectrum SO-0-754-2
Wiley ID 1541588