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2(1H)-Isoquinolinecarboxaldehyde, 1-[(4-ethoxy-3-hydroxyphenyl)methyl]-3,4-dihydro-7-hydroxy-6-methoxy-, (.+-.)-
SpectraBase Compound ID 3JbjENYQnQX
InChI InChI=1S/C20H23NO5/c1-3-26-19-5-4-13(9-17(19)23)8-16-15-11-18(24)20(25-2)10-14(15)6-7-21(16)12-22/h4-5,9-12,16,23-24H,3,6-8H2,1-2H3
InChIKey SJTYYDAIZSNXNM-UHFFFAOYSA-N
Mol Weight 357.41 g/mol
Molecular Formula C20H23NO5
Exact Mass 357.157623 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JdDS7CozQN4
Name 2(1H)-Isoquinolinecarboxaldehyde, 1-[(4-ethoxy-3-hydroxyphenyl)methyl]-3,4-dihydro-7-hydroxy-6-methoxy-, (.+-.)-
CAS Registry Number 98321-32-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H23NO5
InChI InChI=1S/C20H23NO5/c1-3-26-19-5-4-13(9-17(19)23)8-16-15-11-18(24)20(25-2)10-14(15)6-7-21(16)12-22/h4-5,9-12,16,23-24H,3,6-8H2,1-2H3
InChIKey SJTYYDAIZSNXNM-UHFFFAOYSA-N
Molecular Weight 357.406 g/mol
SMILES Oc1c(cc2c(C(Cc3cc(c(cc3)OCC)O)N(CC2)C=O)c1)OC
SPLASH splash10-0a4i-0290000000-282ac5fbbac37c58f946
Source of Spectrum B-38-506-0
Synonyms (+)-1-(4'-ethoxy-3'-hydroxybenzyl)-7-hydroxy-6-methoxy-1,2,3,4-tetraisoquinoline-2-carbaldehyde (+-)-1-(4'-Ethoxy-3'-hydroxybenzyl)-7-hydroxy-6-methoxy-1,2,3,4-tetraisoquinoline-2-carbaldehyde 1-(4-Ethoxy-3-hydroxybenzyl)-7-hydroxy-6-methoxy-3,4-dihydro-2(1H)-isoquinolinecarbaldehyde
Wiley ID 1346489