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1H-Pyrrole-2-carboxylic acid, 4-formyl-3,5-dimethyl-, phenylmethyl ester
SpectraBase Compound ID 38wqhxWzaUG
InChI InChI=1S/C15H15NO3/c1-10-13(8-17)11(2)16-14(10)15(18)19-9-12-6-4-3-5-7-12/h3-8,16H,9H2,1-2H3
InChIKey LHENMNGVFDEKMN-UHFFFAOYSA-N
Mol Weight 257.29 g/mol
Molecular Formula C15H15NO3
Exact Mass 257.105193 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1zxXTs5lTOd
Name 1H-Pyrrole-2-carboxylic acid, 4-formyl-3,5-dimethyl-, phenylmethyl ester
Alternate Name(s) Benzyl 3-formyl-2,4-dimethylpyrrole-5-carboxylate benzyl 4-formyl-3,5-dimethyl-1H-pyrrole-2-carboxylate
CAS Registry Number 37059-12-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H15NO3
InChI InChI=1S/C15H15NO3/c1-10-13(8-17)11(2)16-14(10)15(18)19-9-12-6-4-3-5-7-12/h3-8,16H,9H2,1-2H3
InChIKey LHENMNGVFDEKMN-UHFFFAOYSA-N
Molecular Weight 257.289 g/mol
SMILES [nH]1c(c(c(c1C(OCc1ccccc1)=O)C)C=O)C
SPLASH splash10-0a4i-0390000000-e479034496a70d04d88b
Source of Spectrum J-44-2079-0
Wiley ID 1260859