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1(2H)-Isoquinolinone, 3-(3,4-dimethoxyphenyl)-3,4-dihydro-4-hydroxy-2-methyl-4-phenyl-, cis-(.+-.)-
SpectraBase Compound ID 6Qs97ioWTPw
InChI InChI=1S/C24H23NO4/c1-25-22(16-13-14-20(28-2)21(15-16)29-3)24(27,17-9-5-4-6-10-17)19-12-8-7-11-18(19)23(25)26/h4-15,22,27H,1-3H3/t22-,24+/m1/s1
InChIKey PGWADRDBAKLBOC-VWNXMTODSA-N
Mol Weight 389.45 g/mol
Molecular Formula C24H23NO4
Exact Mass 389.162708 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CZqK73D8v1z
Name 1(2H)-Isoquinolinone, 3-(3,4-dimethoxyphenyl)-3,4-dihydro-4-hydroxy-2-methyl-4-phenyl-, cis-(.+-.)-
Alternate Name(s) (3R,4S)-3-(3,4-dimethoxyphenyl)-4-hydroxy-2-methyl-4-phenyl-3,4-dihydro-1(2H)-isoquinolinone (R*,R*)-and (R*,S*)-3-(3,4-dimethoxyphenyl)-4-hydroxy-4-phenyl-2-methyl-3,4-dihydro-1(2H)-isoquinolones
CAS Registry Number 91613-82-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H23NO4
InChI InChI=1S/C24H23NO4/c1-25-22(16-13-14-20(28-2)21(15-16)29-3)24(27,17-9-5-4-6-10-17)19-12-8-7-11-18(19)23(25)26/h4-15,22,27H,1-3H3/t22-,24+/m1/s1
InChIKey PGWADRDBAKLBOC-VWNXMTODSA-N
Molecular Weight 389.451 g/mol
SMILES O[C@@]1([C@](N(C(c2c1cccc2)=O)C)(c1cc(OC)c(cc1)OC)[H])c1ccccc1
SPLASH splash10-001i-0910000000-1e978a3305763d5aef7f
Source of Spectrum I-62-1398-0
Wiley ID 1364406