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Iso-autumnaline
SpectraBase Compound ID G4LsuxzYl6H
InChI InChI=1S/C21H27NO5/c1-22-8-7-14-11-17(23)19(25-2)12-15(14)16(22)6-5-13-9-18(24)21(27-4)20(10-13)26-3/h9-12,16,23-24H,5-8H2,1-4H3
InChIKey GFNRNKOPJMPASU-UHFFFAOYSA-N
Mol Weight 373.45 g/mol
Molecular Formula C21H27NO5
Exact Mass 373.188923 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8XNqOPk8vCb
Name Iso-autumnaline
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H27NO5
InChI InChI=1S/C21H27NO5/c1-22-8-7-14-11-17(23)19(25-2)12-15(14)16(22)6-5-13-9-18(24)21(27-4)20(10-13)26-3/h9-12,16,23-24H,5-8H2,1-4H3
InChIKey GFNRNKOPJMPASU-UHFFFAOYSA-N
Molecular Weight 373.449 g/mol
SMILES Oc1cc2c(C(CCc3cc(c(c(c3)OC)OC)O)N(CC2)C)cc1OC
SPLASH splash10-052f-0950000000-fb3ceb2a25b78a2a0b39
Source of Spectrum B-47-957-0
Synonyms 1-[2-(3,4-dimethoxy-5-oxidanyl-phenyl)ethyl]-7-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-6-ol 1-[2-(3-hydroxy-4,5-dimethoxyphenyl)ethyl]-7-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-6-ol 1-[2-(3-hydroxy-4,5-dimethoxy-phenyl)ethyl]-7-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-6-ol
Wiley ID 1356144