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4-(3-[2-(4-Bromophenyl)-2-oxoethoxy]-4-methoxyphenyl)octahydro-2H-quinolizin-2-yl (2E)-3-(4-[2-(4-bromophenyl)-2-oxoethoxy]phenyl)-2-propenoate

View entire compound with spectra: 1 MS (GC)

4-(3-[2-(4-Bromophenyl)-2-oxoethoxy]-4-methoxyphenyl)octahydro-2H-quinolizin-2-yl (2E)-3-(4-[2-(4-bromophenyl)-2-oxoethoxy]phenyl)-2-propenoate
SpectraBase Compound ID J18cKeiHLD1
InChI InChI=1S/C41H39Br2NO7/c1-48-39-19-12-30(22-40(39)50-26-38(46)29-10-15-32(43)16-11-29)36-24-35(23-33-4-2-3-21-44(33)36)51-41(47)20-7-27-5-17-34(18-6-27)49-25-37(45)28-8-13-31(42)14-9-28/h5-20,22,33,35-36H,2-4,21,23-26H2,1H3/b20-7+
InChIKey XLRRAGMKARZFPM-IFRROFPPSA-N
Mol Weight 817.6 g/mol
Molecular Formula C41H39Br2NO7
Exact Mass 815.109329 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GplRubVbSqW
Name 4-(3-[2-(4-Bromophenyl)-2-oxoethoxy]-4-methoxyphenyl)octahydro-2H-quinolizin-2-yl (2E)-3-(4-[2-(4-bromophenyl)-2-oxoethoxy]phenyl)-2-propenoate
Alternate Name(s) Rel-(2S,4S,10R)-2-[4-(2-p-bromophenyl-2-oxo-ethyloxy)cinnamyloxy]-4-[3,4-(2-p-bromophenyl-2-oxo-ethyloxy)cinnamyloxy-4-methoxyphenyl]quinolizidine (E)-3-[4-[2-(4-bromophenyl)-2-oxoethoxy]phenyl]-2-propenoic acid [4-[3-[2-(4-bromophenyl)-2-oxoethoxy]-4-methoxyphenyl]-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-2-yl] ester [4-[3-[2-(4-bromophenyl)-2-oxoethoxy]-4-methoxyphenyl]-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-2-yl] (E)-3-[4-[2-(4-bromophenyl)-2-oxoethoxy]phenyl]prop-2-enoate [4-[3-[2-(4-bromophenyl)-2-oxo-ethoxy]-4-methoxy-phenyl]-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-2-yl] (E)-3-[4-[2-(4-bromophenyl)-2-oxo-ethoxy]phenyl]prop-2-enoate [4-[3-[2-(4-bromophenyl)-2-oxidanylidene-ethoxy]-4-methoxy-phenyl]-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-2-yl] (E)-3-[4-[2-(4-bromophenyl)-2-oxidanylidene-ethoxy]phenyl]prop-2-enoate
CAS Registry Number 66393-24-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C41H39Br2NO7
InChI InChI=1S/C41H39Br2NO7/c1-48-39-19-12-30(22-40(39)50-26-38(46)29-10-15-32(43)16-11-29)36-24-35(23-33-4-2-3-21-44(33)36)51-41(47)20-7-27-5-17-34(18-6-27)49-25-37(45)28-8-13-31(42)14-9-28/h5-20,22,33,35-36H,2-4,21,23-26H2,1H3/b20-7+
InChIKey XLRRAGMKARZFPM-IFRROFPPSA-N
Molecular Weight 817.571 g/mol
SMILES COc1c(OCC(=O)c2ccc(Br)cc2)cc(cc1)C1CC(CC2CCCCN12)OC(=O)\C=C\c1ccc(OCC(=O)c2ccc(Br)cc2)cc1
SPLASH splash10-0a5i-1960300000-276265e677a687330f7d
Source of Spectrum W5-1989-65007-529
Wiley ID 1417376