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Ethyl 1-(but-3-enyl)-5-chloro-4-formyl-2-methyl-1H-pyrrole-3-carboxylate
SpectraBase Compound ID 1VWumk3ZxxZ
InChI InChI=1S/C13H16ClNO3/c1-4-6-7-15-9(3)11(13(17)18-5-2)10(8-16)12(15)14/h4,8H,1,5-7H2,2-3H3
InChIKey RNAKAIWHUZUPQD-UHFFFAOYSA-N
Mol Weight 269.73 g/mol
Molecular Formula C13H16ClNO3
Exact Mass 269.081871 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 30h1wQVA362
Name Ethyl 1-(but-3-enyl)-5-chloro-4-formyl-2-methyl-1H-pyrrole-3-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16ClNO3
InChI InChI=1S/C13H16ClNO3/c1-4-6-7-15-9(3)11(13(17)18-5-2)10(8-16)12(15)14/h4,8H,1,5-7H2,2-3H3
InChIKey RNAKAIWHUZUPQD-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol901498f
Molecular Weight 269.728 g/mol
SMILES c1(c(c(C=O)c(Cl)[n]1CCC=C)C(OCC)=O)C
SPLASH splash10-0a4r-9240000000-5ac5b4095cb6ac6e27e4
Source of Spectrum A1-11-3902/SMS10-1p
Synonyms Ethyl 1-(but-3-en-1-yl)-5-chloro-4-formyl-2-methyl-1H-pyrrole-3-carboxylate
Wiley ID 1757231