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(phenylmethyl) 4-(3-ethoxyphenyl)-2,7,7-trimethyl-5-oxidanylidene-1,4,6,8-tetrahydroquinoline-3-carboxylate
SpectraBase Compound ID IIerwGaXMHG
InChI InChI=1S/C28H31NO4/c1-5-32-21-13-9-12-20(14-21)25-24(27(31)33-17-19-10-7-6-8-11-19)18(2)29-22-15-28(3,4)16-23(30)26(22)25/h6-14,25,29H,5,15-17H2,1-4H3
InChIKey FDTIDYNSCPMNCV-UHFFFAOYSA-N
Mol Weight 445.56 g/mol
Molecular Formula C28H31NO4
Exact Mass 445.225308 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Jw1TCjjnXV0
Name (phenylmethyl) 4-(3-ethoxyphenyl)-2,7,7-trimethyl-5-oxidanylidene-1,4,6,8-tetrahydroquinoline-3-carboxylate
Alternate Name(s) 4-(3-Ethoxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylic acid (phenylmethyl) ester 5-keto-2,7,7-trimethyl-4-m-phenetyl-1,4,6,8-tetrahydroquinoline-3-carboxylic acid benzyl ester benzyl 4-(3-ethoxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate
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Formula C28H31NO4
InChI InChI=1S/C28H31NO4/c1-5-32-21-13-9-12-20(14-21)25-24(27(31)33-17-19-10-7-6-8-11-19)18(2)29-22-15-28(3,4)16-23(30)26(22)25/h6-14,25,29H,5,15-17H2,1-4H3
InChIKey FDTIDYNSCPMNCV-UHFFFAOYSA-N
Molecular Weight 445.559 g/mol
SMILES N1C(=C(C(C=2C(CC(CC12)(C)C)=O)c1cc(OCC)ccc1)C(OCc1ccccc1)=O)C
SPLASH splash10-00dl-6629000000-8af762f5006bfa994740
Wiley ID 1460643