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2-(3-Methyl-1-phenyl-1H-pyrrol-2-yl)hexanoic acid methyl ester
SpectraBase Compound ID 76yQTGCmzvW
InChI InChI=1S/C18H23NO2/c1-4-5-11-16(18(20)21-3)17-14(2)12-13-19(17)15-9-7-6-8-10-15/h6-10,12-13,16H,4-5,11H2,1-3H3
InChIKey RQTOVKFRBCZUDE-UHFFFAOYSA-N
Mol Weight 285.39 g/mol
Molecular Formula C18H23NO2
Exact Mass 285.172879 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E8Mly2bcM67
Name 2-(3-Methyl-1-phenyl-1H-pyrrol-2-yl)hexanoic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H23NO2
InChI InChI=1S/C18H23NO2/c1-4-5-11-16(18(20)21-3)17-14(2)12-13-19(17)15-9-7-6-8-10-15/h6-10,12-13,16H,4-5,11H2,1-3H3
InChIKey RQTOVKFRBCZUDE-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.200606085
Molecular Weight 285.387 g/mol
SMILES C(C(CCCC)c1[n](ccc1C)-c1ccccc1)(=O)OC
SPLASH splash10-00b9-0890000000-719a702f0ca53db1a309
Source of Spectrum ASC-348-2212/SM6-2h
Synonyms Methyl 2-(3-methyl-1-phenyl-1H-pyrrol-2-yl)hexanoate
Wiley ID 1764993