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1,3-Dioxolo[4,5-g]isoquinoline, 5-[2-(1,3-benzodioxol-5-yl)ethyl]-5,6,7,8-tetrahydro-6-methyl-, (.+-.)-
SpectraBase Compound ID 1yJcVtJU6VC
InChI InChI=1S/C20H21NO4/c1-21-7-6-14-9-19-20(25-12-24-19)10-15(14)16(21)4-2-13-3-5-17-18(8-13)23-11-22-17/h3,5,8-10,16H,2,4,6-7,11-12H2,1H3
InChIKey XLPHZFZMGWRCDI-UHFFFAOYSA-N
Mol Weight 339.39 g/mol
Molecular Formula C20H21NO4
Exact Mass 339.147058 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EvNMh5GmXML
Name 1,3-Dioxolo[4,5-g]isoquinoline, 5-[2-(1,3-benzodioxol-5-yl)ethyl]-5,6,7,8-tetrahydro-6-methyl-, (.+-.)-
CAS Registry Number 100077-54-1
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H21NO4
InChI InChI=1S/C20H21NO4/c1-21-7-6-14-9-19-20(25-12-24-19)10-15(14)16(21)4-2-13-3-5-17-18(8-13)23-11-22-17/h3,5,8-10,16H,2,4,6-7,11-12H2,1H3
InChIKey XLPHZFZMGWRCDI-UHFFFAOYSA-N
Molecular Weight 339.391 g/mol
SMILES c12C(N(C)CCc2cc2c(c1)OCO2)CCc1cc2OCOc2cc1
SPLASH splash10-0006-0900000000-10668751cf36df6005f9
Source of Spectrum B-38-562-2
Synonyms 2-Methyl-6,7-methylenedioxy-1-(3,4-methylenedioxyphenylethyl)-1,2,3,4-tetrahydroisoquinoline 5-[2-(1,3-benzodioxol-5-yl)ethyl]-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinoline
Wiley ID 1334575