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Methyl 5-(1,1-dimethyl-5-oxohexyl)-2-methyl-1H-pyrrole-3-carboxylate
SpectraBase Compound ID H4g0A3WlaWe
InChI InChI=1S/C15H23NO3/c1-10(17)7-6-8-15(3,4)13-9-12(11(2)16-13)14(18)19-5/h9,16H,6-8H2,1-5H3
InChIKey SDZHIYIQBIJYPF-UHFFFAOYSA-N
Mol Weight 265.35 g/mol
Molecular Formula C15H23NO3
Exact Mass 265.167794 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JUYoAUkmEdn
Name Methyl 5-(1,1-dimethyl-5-oxohexyl)-2-methyl-1H-pyrrole-3-carboxylate
CAS Registry Number 107675-02-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H23NO3
InChI InChI=1S/C15H23NO3/c1-10(17)7-6-8-15(3,4)13-9-12(11(2)16-13)14(18)19-5/h9,16H,6-8H2,1-5H3
InChIKey SDZHIYIQBIJYPF-UHFFFAOYSA-N
Molecular Weight 265.353 g/mol
SMILES [nH]1c(c(cc1C(C)(C)CCCC(=O)C)C(=O)OC)C
SPLASH splash10-001i-2900000000-2bfafbf7ebbac7ffd6c1
Source of Spectrum CM-1999-15154-0
Synonyms 5-(1,1-Dimethyl-5-oxohexyl)-2-methyl-1H-pyrrole-3-carboxylic acid, methyl ester 2-Methyl-5-(2-methyl-6-oxoheptan-2-yl)-1H-pyrrole-3-carboxylic acid methyl ester 5-(5-keto-1,1-dimethyl-hexyl)-2-methyl-1H-pyrrole-3-carboxylic acid methyl ester Methyl 5-(1,1-dimethyl-5-oxo-hexyl)-2-methyl-1H-pyrrole-3-carboxylate Methyl 2-methyl-5-(2-methyl-6-oxidanylidene-heptan-2-yl)-1H-pyrrole-3-carboxylate Methyl 2-methyl-5-(2-methyl-6-oxoheptan-2-yl)-1H-pyrrole-3-carboxylate
Wiley ID 477508