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3,4-Dimethoxy-6-methyl-5,7,8,15-tetrahydrobenzo[c][1,3]benzodioxolo[5,6-g]azecin-14(6H)-one hydrochloride
SpectraBase Compound ID 7EhZw5Rh2r6
InChI InChI=1S/C21H23NO5.Cl/c1-22-7-6-14-9-19-20(27-12-26-19)10-15(14)17(23)8-13-4-5-18(24-2)21(25-3)16(13)11-22;/h4-5,9-10H,6-8,11-12H2,1-3H3;
InChIKey KCEFRVZPSPCBEU-UHFFFAOYSA-N
Mol Weight 404.87 g/mol
Molecular Formula C21H23ClNO5
Exact Mass 404.126476 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1Yy3nTqFiiu
Name 3,4-Dimethoxy-6-methyl-5,7,8,15-tetrahydrobenzo[c][1,3]benzodioxolo[5,6-g]azecin-14(6H)-one hydrochloride
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H24ClNO5
InChI InChI=1S/C21H23NO5.Cl/c1-22-7-6-14-9-19-20(27-12-26-19)10-15(14)17(23)8-13-4-5-18(24-2)21(25-3)16(13)11-22;/h4-5,9-10H,6-8,11-12H2,1-3H3;
InChIKey KCEFRVZPSPCBEU-UHFFFAOYSA-N
Molecular Weight 405.878 g/mol
SMILES Cl.c12c(CC(c3cc4OCOc4cc3CCN(C2)C)=O)ccc(c1OC)OC
SPLASH splash10-03di-4920000000-1576a2d49c3399b86864
Synonyms [1,3]benzodioxolo[5,6-e][2]benzazecin-14(6H)-one, 5,7,8,15-tetrahydro-3,4-dimethoxy-6-methyl-, hydrochloride
Wiley ID 1453706