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1,3-Benzodioxole-4-carboxaldehyde, 5-[(5,6,7,8-tetrahydro-6-methyl-1,3-dioxolo[4,5-g]isoquinolin-5-yl)methyl]-, (.+-.)-
SpectraBase Compound ID Bg84cc04zgL
InChI InChI=1S/C20H19NO5/c1-21-5-4-13-7-18-19(25-10-24-18)8-14(13)16(21)6-12-2-3-17-20(15(12)9-22)26-11-23-17/h2-3,7-9,16H,4-6,10-11H2,1H3
InChIKey HYWZGQMUNYHGNN-UHFFFAOYSA-N
Mol Weight 353.37 g/mol
Molecular Formula C20H19NO5
Exact Mass 353.126323 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ArLvU2za9M1
Name 1,3-Benzodioxole-4-carboxaldehyde, 5-[(5,6,7,8-tetrahydro-6-methyl-1,3-dioxolo[4,5-g]isoquinolin-5-yl)methyl]-, (.+-.)-
CAS Registry Number 64598-67-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H19NO5
InChI InChI=1S/C20H19NO5/c1-21-5-4-13-7-18-19(25-10-24-18)8-14(13)16(21)6-12-2-3-17-20(15(12)9-22)26-11-23-17/h2-3,7-9,16H,4-6,10-11H2,1H3
InChIKey HYWZGQMUNYHGNN-UHFFFAOYSA-N
Molecular Weight 353.374 g/mol
SMILES c12C(N(C)CCc2cc2c(c1)OCO2)Cc1c(c2OCOc2cc1)C=O
SPLASH splash10-0006-0900000000-d7bd1a694be50dfd8b9b
Source of Spectrum F-44-1225-2
Synonyms 1,3-Dioxolo[4,5-g]isoquinoline, 1,3-benzodioxole-4-carboxaldehyde deriv. (+-)-Aobamine (.+-.)-Aobamine 3(n)-methyl-4-(7-oxymethyl-3-oxabenzofuran-7-yl)methyl(1,2,3,4,5,6-hexahydropyridino[3,4-f]3-oxabenzofuran) 5-[(6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-5-yl)methyl]-1,3-benzodioxole-4-carbaldehyde
Wiley ID 1343959