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5-[(Benzyloxy)carbonyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid
SpectraBase Compound ID 8y1pN3jj819
InChI InChI=1S/C15H15NO4/c1-9-12(14(17)18)10(2)16-13(9)15(19)20-8-11-6-4-3-5-7-11/h3-7,16H,8H2,1-2H3,(H,17,18)
InChIKey UKIAVYVRZNDPNZ-UHFFFAOYSA-N
Mol Weight 273.29 g/mol
Molecular Formula C15H15NO4
Exact Mass 273.100108 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Js4sczsHT8n
Name 5-[(Benzyloxy)carbonyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid
Alternate Name(s) 2,4-Dimethyl-5-phenylmethoxycarbonyl-1H-pyrrole-3-carboxylic acid 5-carbobenzoxy-2,4-dimethyl-1H-pyrrole-3-carboxylic acid Pyrrole-2,4-dicarboxylic acid, 3,5-dimethyl-, 2-benzyl ester
CAS Registry Number 69912-09-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H15NO4
InChI InChI=1S/C15H15NO4/c1-9-12(14(17)18)10(2)16-13(9)15(19)20-8-11-6-4-3-5-7-11/h3-7,16H,8H2,1-2H3,(H,17,18)
InChIKey UKIAVYVRZNDPNZ-UHFFFAOYSA-N
Molecular Weight 273.288 g/mol
SMILES [nH]1c(c(c(C(=O)O)c1C)C)C(OCc1ccccc1)=O
SPLASH splash10-0006-9210000000-82c644a0fb8e4300ce19
Source of Spectrum AD-0-2532-0
Wiley ID 1430156