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1(2H)-Isoquinolinone, 3-(1,3-benzodioxol-5-yl)-3,4-dihydro-6,7-dimethoxy-2-methyl-
SpectraBase Compound ID 6OSubQMTT9i
InChI InChI=1S/C19H19NO5/c1-20-14(11-4-5-15-18(7-11)25-10-24-15)6-12-8-16(22-2)17(23-3)9-13(12)19(20)21/h4-5,7-9,14H,6,10H2,1-3H3
InChIKey VVYLLIXLQAJRNM-UHFFFAOYSA-N
Mol Weight 341.36 g/mol
Molecular Formula C19H19NO5
Exact Mass 341.126323 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FbreEfNdEPt
Name 1(2H)-Isoquinolinone, 3-(1,3-benzodioxol-5-yl)-3,4-dihydro-6,7-dimethoxy-2-methyl-
CAS Registry Number 87922-31-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H19NO5
InChI InChI=1S/C19H19NO5/c1-20-14(11-4-5-15-18(7-11)25-10-24-15)6-12-8-16(22-2)17(23-3)9-13(12)19(20)21/h4-5,7-9,14H,6,10H2,1-3H3
InChIKey VVYLLIXLQAJRNM-UHFFFAOYSA-N
Molecular Weight 341.363 g/mol
SMILES C1(N(C(c2cc3OCOc3cc2)Cc2c1cc(c(OC)c2)OC)C)=O
SPLASH splash10-0fb9-0911000000-3106087977e634376dfa
Source of Spectrum J-53-2379-17
Synonyms 3-(1,3-benzodioxol-5-yl)-6,7-dimethoxy-2-methyl-3,4-dihydro-1(2H)-isoquinolinone
Wiley ID 1335918