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4-[3-keto-3-methoxy-2-(methylthio)propyl]-3,5-dimethyl-1H-pyrrole-2-carboxylic acid methyl ester
SpectraBase Compound ID F3eihqjX6VG
InChI InChI=1S/C13H19NO4S/c1-7-9(6-10(19-5)12(15)17-3)8(2)14-11(7)13(16)18-4/h10,14H,6H2,1-5H3
InChIKey GEJRPKLLBXANML-UHFFFAOYSA-N
Mol Weight 285.36 g/mol
Molecular Formula C13H19NO4S
Exact Mass 285.103479 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9i6QmY5lGCM
Name 4-[3-keto-3-methoxy-2-(methylthio)propyl]-3,5-dimethyl-1H-pyrrole-2-carboxylic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H19NO4S
InChI InChI=1S/C13H19NO4S/c1-7-9(6-10(19-5)12(15)17-3)8(2)14-11(7)13(16)18-4/h10,14H,6H2,1-5H3
InChIKey GEJRPKLLBXANML-UHFFFAOYSA-N
Molecular Weight 285.358 g/mol
SMILES [nH]1c(c(c(c1C(=O)OC)C)CC(C(=O)OC)SC)C
SPLASH splash10-0159-0910000000-92d7c8a4cdf96803450b
Source of Spectrum J-63-6227-10
Synonyms 4-[3-methoxy-2-(methylthio)-3-oxopropyl]-3,5-dimethyl-1H-pyrrole-2-carboxylic acid methyl ester Methyl 4-(3-methoxy-2-methylsulfanyl-3-oxidanylidene-propyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate Methyl 4-(3-methoxy-2-methylsulfanyl-3-oxopropyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate
Wiley ID 1288783