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6,7-Dimethoxy-3-[3-(methoxymethoxymethyl)-5,6-(methylenedioxy)phenyl]isoquinoline-1(2H)-one
SpectraBase Compound ID HJmHahcPl4j
InChI InChI=1S/C21H21NO7/c1-24-10-27-9-12-4-15(20-19(5-12)28-11-29-20)16-6-13-7-17(25-2)18(26-3)8-14(13)21(23)22-16/h4-8H,9-11H2,1-3H3,(H,22,23)
InChIKey HWUNBZHRXGZZPN-UHFFFAOYSA-N
Mol Weight 399.4 g/mol
Molecular Formula C21H21NO7
Exact Mass 399.131802 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1sezmF5MyXI
Name 6,7-Dimethoxy-3-[3-(methoxymethoxymethyl)-5,6-(methylenedioxy)phenyl]isoquinoline-1(2H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H21NO7
InChI InChI=1S/C21H21NO7/c1-24-10-27-9-12-4-15(20-19(5-12)28-11-29-20)16-6-13-7-17(25-2)18(26-3)8-14(13)21(23)22-16/h4-8H,9-11H2,1-3H3,(H,22,23)
InChIKey HWUNBZHRXGZZPN-UHFFFAOYSA-N
Molecular Weight 399.399 g/mol
SMILES N1C(c2c(C=C1c1c3c(OCO3)cc(c1)COCOC)cc(c(c2)OC)OC)=O
SPLASH splash10-000i-0009000000-715a8cdd6d6eb43777d6
Source of Spectrum Y1-45-2766-7
Synonyms 6,7-Dimethoxy-3-{6-[(methoxymethoxy)methyl]-1,3-benzodioxol-4-yl}-1(2H)-isoquinolinone
Wiley ID 1621934