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1H-Pyrrole-2-carboxylic acid, 4-(2-furanylcarbonyl)-3-(methylthio)-5-phenyl-, ethyl ester
SpectraBase Compound ID 3EQcq8jJqh2
InChI InChI=1S/C19H17NO4S/c1-3-23-19(22)16-18(25-2)14(17(21)13-10-7-11-24-13)15(20-16)12-8-5-4-6-9-12/h4-11,20H,3H2,1-2H3
InChIKey BBLFOYDPPVPHFY-UHFFFAOYSA-N
Mol Weight 355.41 g/mol
Molecular Formula C19H17NO4S
Exact Mass 355.087829 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GSLYSHgGMV7
Name 1H-Pyrrole-2-carboxylic acid, 4-(2-furanylcarbonyl)-3-(methylthio)-5-phenyl-, ethyl ester
Alternate Name(s) 4-(2-furoyl)-3-(methylthio)-5-phenyl-1H-pyrrole-2-carboxylic acid ethyl ester 4-[2-furanyl(oxo)methyl]-3-(methylthio)-5-phenyl-1H-pyrrole-2-carboxylic acid ethyl ester Ethyl 4-(furan-2-carbonyl)-3-methylsulfanyl-5-phenyl-1H-pyrrole-2-carboxylate Ethyl 4-(furan-2-ylcarbonyl)-3-methylsulfanyl-5-phenyl-1H-pyrrole-2-carboxylate
CAS Registry Number 132058-94-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H17NO4S
InChI InChI=1S/C19H17NO4S/c1-3-23-19(22)16-18(25-2)14(17(21)13-10-7-11-24-13)15(20-16)12-8-5-4-6-9-12/h4-11,20H,3H2,1-2H3
InChIKey BBLFOYDPPVPHFY-UHFFFAOYSA-N
Molecular Weight 355.408 g/mol
SMILES [nH]1c(c(c(c1-c1ccccc1)C(c1occc1)=O)SC)C(=O)OCC
SPLASH splash10-0a4i-0019000000-820e9e1873a2b8584672
Source of Spectrum F-46-6781-25
Wiley ID 1345207