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Methyl 4-(2-methylphenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate
SpectraBase Compound ID JewULApQMh2
InChI InChI=1S/C21H25NO3/c1-12-8-6-7-9-14(12)18-17(20(24)25-5)13(2)22-15-10-21(3,4)11-16(23)19(15)18/h6-9,18,22H,10-11H2,1-5H3
InChIKey OLAZKTCCRHMVGF-UHFFFAOYSA-N
Mol Weight 339.44 g/mol
Molecular Formula C21H25NO3
Exact Mass 339.183444 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3ICazOMStE
Name Methyl 4-(2-methylphenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate
Alternate Name(s) Methyl 2,7,7-trimethyl-5-oxo-4-(o-tolyl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H25NO3
InChI InChI=1S/C21H25NO3/c1-12-8-6-7-9-14(12)18-17(20(24)25-5)13(2)22-15-10-21(3,4)11-16(23)19(15)18/h6-9,18,22H,10-11H2,1-5H3
InChIKey OLAZKTCCRHMVGF-UHFFFAOYSA-N
Literature Reference DOI 10.1002/aoc.3136
Molecular Weight 339.435 g/mol
SMILES N1C(=C(C(C=2C(CC(CC12)(C)C)=O)c1c(cccc1)C)C(OC)=O)C
SPLASH splash10-000f-4009000000-a456ceddc0c80837298d
Source of Spectrum AOC-28-359/SM2-4c
Wiley ID 1768622