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3-Methyl-2-undecyl-1H-quinolin-4-one

View entire compound with spectra: 2 MS (GC)

3-Methyl-2-undecyl-1H-quinolin-4-one
SpectraBase Compound ID HQB3FHeSDMk
InChI InChI=1S/C21H31NO/c1-3-4-5-6-7-8-9-10-11-15-19-17(2)21(23)18-14-12-13-16-20(18)22-19/h12-14,16H,3-11,15H2,1-2H3,(H,22,23)
InChIKey JGTXLAJOIAGIHI-UHFFFAOYSA-N
Mol Weight 313.49 g/mol
Molecular Formula C21H31NO
Exact Mass 313.240565 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Lpst9woEhne
Name 3-Methyl-2-undecyl-1H-quinolin-4-one
Alternate Name(s) 3-Methyl-2-undecyl-4(1H)-quinolinone 3-Methyl-2-undecyl-4-quinolone
CAS Registry Number 185854-84-6
Comments Structure changed after expert review
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H31NO
InChI InChI=1S/C21H31NO/c1-3-4-5-6-7-8-9-10-11-15-19-17(2)21(23)18-14-12-13-16-20(18)22-19/h12-14,16H,3-11,15H2,1-2H3,(H,22,23)
InChIKey JGTXLAJOIAGIHI-UHFFFAOYSA-N
Molecular Weight 313.485 g/mol
SMILES N1C(=C(C(c2ccccc12)=O)C)CCCCCCCCCCC
SPLASH splash10-00dr-1920000000-6b516cbfa4f69f59f620
Wiley ID 1474986