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2-(1-tert-Butyl-3-methyl-1H-pyrrol-2-yl)hexanoic acid methyl ester
SpectraBase Compound ID DfZ9mRkSGMR
InChI InChI=1S/C16H27NO2/c1-7-8-9-13(15(18)19-6)14-12(2)10-11-17(14)16(3,4)5/h10-11,13H,7-9H2,1-6H3
InChIKey JEDUBSKHIXFRHD-UHFFFAOYSA-N
Mol Weight 265.4 g/mol
Molecular Formula C16H27NO2
Exact Mass 265.204179 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID UY2g0ILFKu
Name 2-(1-tert-Butyl-3-methyl-1H-pyrrol-2-yl)hexanoic acid methyl ester
Alternate Name(s) Methyl 2-(1-(tert-butyl)-3-methyl-1H-pyrrol-2-yl)hexanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H27NO2
InChI InChI=1S/C16H27NO2/c1-7-8-9-13(15(18)19-6)14-12(2)10-11-17(14)16(3,4)5/h10-11,13H,7-9H2,1-6H3
InChIKey JEDUBSKHIXFRHD-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.200606085
Molecular Weight 265.397 g/mol
SMILES C(C(CCCC)c1[n](ccc1C)C(C)(C)C)(=O)OC
SPLASH splash10-0udi-1920000000-20202a5f155c26fb25ce
Source of Spectrum ASC-348-2212/SM6-2g
Wiley ID 1764992