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(S)-(+)-3-(3,4-Dimethoxyphenyl)-2-(2,2-dimethoxyethyl)-3,4-dihydro-1(2H)-isoquinolone
SpectraBase Compound ID 4QmplrBdSed
InChI InChI=1S/C21H25NO5/c1-24-18-10-9-15(12-19(18)25-2)17-11-14-7-5-6-8-16(14)21(23)22(17)13-20(26-3)27-4/h5-10,12,17,20H,11,13H2,1-4H3/t17-/m0/s1
InChIKey LTGANBFRQIBGLJ-KRWDZBQOSA-N
Mol Weight 371.43 g/mol
Molecular Formula C21H25NO5
Exact Mass 371.173273 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FvEHvMo7mIp
Name (S)-(+)-3-(3,4-Dimethoxyphenyl)-2-(2,2-dimethoxyethyl)-3,4-dihydro-1(2H)-isoquinolone
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Formula C21H25NO5
InChI InChI=1S/C21H25NO5/c1-24-18-10-9-15(12-19(18)25-2)17-11-14-7-5-6-8-16(14)21(23)22(17)13-20(26-3)27-4/h5-10,12,17,20H,11,13H2,1-4H3/t17-/m0/s1
InChIKey LTGANBFRQIBGLJ-KRWDZBQOSA-N
Molecular Weight 371.433 g/mol
SMILES C1(N([C@@](Cc2ccccc12)(c1cc(c(cc1)OC)OC)[H])CC(OC)OC)=O
SPLASH splash10-0059-9462000000-2ba162eab10421b450de
Source of Spectrum KD-16-2957-7
Synonyms (3S)-2-(2,2-dimethoxyethyl)-3-(3,4-dimethoxyphenyl)-3,4-dihydro-1(2H)-isoquinolinone
Wiley ID 1637946