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Ethyl 3-(4-bromophenyl)-4-formyl-5-(ethylsulfanyl)-1H-pyrrole-2-carboxylate
SpectraBase Compound ID KmQE365TpNm
InChI InChI=1S/C16H16BrNO3S/c1-3-21-16(20)14-13(10-5-7-11(17)8-6-10)12(9-19)15(18-14)22-4-2/h5-9,18H,3-4H2,1-2H3
InChIKey AYARDKBJQYSUMC-UHFFFAOYSA-N
Mol Weight 382.27 g/mol
Molecular Formula C16H16BrNO3S
Exact Mass 381.003428 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 97n9T9y8KG9
Name Ethyl 3-(4-bromophenyl)-4-formyl-5-(ethylsulfanyl)-1H-pyrrole-2-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H16BrNO3S
InChI InChI=1S/C16H16BrNO3S/c1-3-21-16(20)14-13(10-5-7-11(17)8-6-10)12(9-19)15(18-14)22-4-2/h5-9,18H,3-4H2,1-2H3
InChIKey AYARDKBJQYSUMC-UHFFFAOYSA-N
Molecular Weight 382.272 g/mol
SMILES [nH]1c(c(c(c1C(=O)OCC)-c1ccc(cc1)Br)C=O)SCC
SPLASH splash10-0ue9-0019000000-c0f7e1ab4d34acd02b95
Source of Spectrum F-62-1714-5
Synonyms Ethyl 3-(4-bromophenyl)-5-(ethylsulfanyl)-4-formyl-1H-pyrrole-2-carboxylate
Wiley ID 1632259