1,3-Dioxolo[4,5-g]isoquinoline-5-methanol, .alpha.-(2-bromo-3,4-dimethoxyphenyl)-6-(2,2-dimethyl-1-oxopropyl)-5,6,7,8-tetrahydro-, (R*,S*)-(.+-.)-

SpectraBase Compound ID	6q02lIxkyQj
InChI	InChI=1S/C24H28BrNO6/c1-24(2,3)23(28)26-9-8-13-10-17-18(32-12-31-17)11-15(13)20(26)21(27)14-6-7-16(29-4)22(30-5)19(14)25/h6-7,10-11,20-21,27H,8-9,12H2,1-5H3
InChIKey	ZCCKLMKGPGLIIE-UHFFFAOYSA-N Google Search
Mol Weight	506.39 g/mol
Molecular Formula	C24H28BrNO6
Exact Mass	505.110001 g/mol

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SpectraBase Spectrum ID	MQBDvu9jo2
Name	1,3-Dioxolo[4,5-g]isoquinoline-5-methanol, .alpha.-(2-bromo-3,4-dimethoxyphenyl)-6-(2,2-dimethyl-1-oxopropyl)-5,6,7,8-tetrahydro-, (R,S)-(.+-.)-
CAS Registry Number	104270-80-6
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C24H28BrNO6
InChI	InChI=1S/C24H28BrNO6/c1-24(2,3)23(28)26-9-8-13-10-17-18(32-12-31-17)11-15(13)20(26)21(27)14-6-7-16(29-4)22(30-5)19(14)25/h6-7,10-11,20-21,27H,8-9,12H2,1-5H3
InChIKey	ZCCKLMKGPGLIIE-UHFFFAOYSA-N
Molecular Weight	506.393 g/mol
SMILES	OC(C1c2c(cc3c(c2)OCO3)CCN1C(=O)C(C)(C)C)c1c(c(c(cc1)OC)OC)Br
SPLASH	splash10-08fr-9570000000-e0171284d915566c3f7c
Synonyms	(2-Bromo-3,4-dimethoxyphenyl)[6-(2,2-dimethylpropanoyl)-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-5-yl]methanol 1-[5-[(2-bromanyl-3,4-dimethoxy-phenyl)-oxidanyl-methyl]-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-6-yl]-2,2-dimethyl-propan-1-one 1-[5-[(2-bromo-3,4-dimethoxy-phenyl)-hydroxy-methyl]-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-6-yl]-2,2-dimethyl-propan-1-one 1-[5-[(2-bromo-3,4-dimethoxy-phenyl)-hydroxy-methyl]-7,8-dihydro-5H-[1,3]dioxol[4,5-g]isoquinolin-6-yl]-2,2-dimethyl-propan-1-one 1-[5-[(2-bromo-3,4-dimethoxyphenyl)-hydroxymethyl]-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-6-yl]-2,2-dimethyl-1-propanone
Wiley ID	1485461