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2,7,7-trimethyl-5-oxo-4-phenyl-1,4,6,8-tetrahydroquinoline-3-carboxylic acid propan-2-yl ester
SpectraBase Compound ID 6EeBbotZqQ6
InChI InChI=1S/C22H27NO3/c1-13(2)26-21(25)18-14(3)23-16-11-22(4,5)12-17(24)20(16)19(18)15-9-7-6-8-10-15/h6-10,13,19,23H,11-12H2,1-5H3
InChIKey CJMMZSRUBYIPBE-UHFFFAOYSA-N
Mol Weight 353.46 g/mol
Molecular Formula C22H27NO3
Exact Mass 353.199094 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CLGH3vqA80i
Name 2,7,7-trimethyl-5-oxo-4-phenyl-1,4,6,8-tetrahydroquinoline-3-carboxylic acid propan-2-yl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H27NO3
InChI InChI=1S/C22H27NO3/c1-13(2)26-21(25)18-14(3)23-16-11-22(4,5)12-17(24)20(16)19(18)15-9-7-6-8-10-15/h6-10,13,19,23H,11-12H2,1-5H3
InChIKey CJMMZSRUBYIPBE-UHFFFAOYSA-N
Molecular Weight 353.462 g/mol
SMILES N1C(=C(C(C2=C1CC(CC2=O)(C)C)c1ccccc1)C(OC(C)C)=O)C
SPLASH splash10-0059-2391000000-30461bee84f5e194dc99
Synonyms 5-keto-2,7,7-trimethyl-4-phenyl-1,4,6,8-tetrahydroquinoline-3-carboxylic acid isopropyl ester isopropyl 2,7,7-trimethyl-5-oxo-4-phenyl-1,4,6,8-tetrahydroquinoline-3-carboxylate Propan-2-yl 2,7,7-trimethyl-5-oxidanylidene-4-phenyl-1,4,6,8-tetrahydroquinoline-3-carboxylate Propan-2-yl 2,7,7-trimethyl-5-oxo-4-phenyl-1,4,6,8-tetrahydroquinoline-3-carboxylate
Wiley ID 1457071