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5-[4-(7,8-dimethoxy-5-quinolinyl)-1-[3-(3-methyl-1-azecanyl)propyl]-3-pyrrolyl]-7,8-dimethoxyquinoline
SpectraBase Compound ID 1xfe3RXPus0
InChI InChI=1S/C39H48N4O4/c1-27-14-9-7-6-8-10-19-42(24-27)20-13-21-43-25-32(30-22-34(44-2)38(46-4)36-28(30)15-11-17-40-36)33(26-43)31-23-35(45-3)39(47-5)37-29(31)16-12-18-41-37/h11-12,15-18,22-23,25-27H,6-10,13-14,19-21,24H2,1-5H3
InChIKey JIFDTYHYGJJBSF-UHFFFAOYSA-N
Mol Weight 636.8 g/mol
Molecular Formula C39H48N4O4
Exact Mass 636.367556 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6I5Plf47jh3
Name 5-[4-(7,8-dimethoxy-5-quinolinyl)-1-[3-(3-methyl-1-azecanyl)propyl]-3-pyrrolyl]-7,8-dimethoxyquinoline
Alternate Name(s) 5-[4-(7,8-dimethoxy-5-quinolyl)-1-[3-(3-methylazecan-1-yl)propyl]pyrrol-3-yl]-7,8-dimethoxy-quinoline 5-[4-(7,8-dimethoxyquinolin-5-yl)-1-[3-(3-methylazecan-1-yl)propyl]pyrrol-3-yl]-7,8-dimethoxy-quinoline
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C39H48N4O4
InChI InChI=1S/C39H48N4O4/c1-27-14-9-7-6-8-10-19-42(24-27)20-13-21-43-25-32(30-22-34(44-2)38(46-4)36-28(30)15-11-17-40-36)33(26-43)31-23-35(45-3)39(47-5)37-29(31)16-12-18-41-37/h11-12,15-18,22-23,25-27H,6-10,13-14,19-21,24H2,1-5H3
InChIKey JIFDTYHYGJJBSF-UHFFFAOYSA-N
Molecular Weight 636.837 g/mol
SMILES c1(c(-c2c3c(nccc3)c(c(c2)OC)OC)c[n](c1)CCCN1CC(C)CCCCCCC1)-c1c2c(nccc2)c(c(c1)OC)OC
SPLASH splash10-000i-0100309000-024ba22adfeaa637671e
Source of Spectrum K-2002-1342-3
Wiley ID 1581224