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4-[(7-methoxy-2-methyl-8-oxidanyl-3,4-dihydro-1H-isoquinolin-1-yl)methyl]benzene-1,2-diol
SpectraBase Compound ID 6ijqLJgrNrK
InChI InChI=1S/C18H21NO4/c1-19-8-7-12-4-6-16(23-2)18(22)17(12)13(19)9-11-3-5-14(20)15(21)10-11/h3-6,10,13,20-22H,7-9H2,1-2H3
InChIKey VRBRAFCNMOMRMY-UHFFFAOYSA-N
Mol Weight 315.37 g/mol
Molecular Formula C18H21NO4
Exact Mass 315.147058 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8m1oIgm3GsD
Name 4-[(7-methoxy-2-methyl-8-oxidanyl-3,4-dihydro-1H-isoquinolin-1-yl)methyl]benzene-1,2-diol
CAS Registry Number 113756-46-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H21NO4
InChI InChI=1S/C18H21NO4/c1-19-8-7-12-4-6-16(23-2)18(22)17(12)13(19)9-11-3-5-14(20)15(21)10-11/h3-6,10,13,20-22H,7-9H2,1-2H3
InChIKey VRBRAFCNMOMRMY-UHFFFAOYSA-N
Molecular Weight 315.369 g/mol
SMILES Oc1c2C(Cc3ccc(c(c3)O)O)N(CCc2ccc1OC)C
SPLASH splash10-01ox-0936000000-1790855552362cfdb3c5
Source of Spectrum Y-24-618-8
Synonyms 4-[(8-hydroxy-7-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl)methyl]benzene-1,2-diol 4-[(8-hydroxy-7-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl)methyl]pyrocatechol
Wiley ID 1316039