3-([1,1'-Biphenyl]-4-yl)-4-n-butyl-1-methylisoquinoline

SpectraBase Compound ID	CO6fa3d454J
InChI	InChI=1S/C26H25N/c1-3-4-12-25-24-14-9-8-13-23(24)19(2)27-26(25)22-17-15-21(16-18-22)20-10-6-5-7-11-20/h5-11,13-18H,3-4,12H2,1-2H3
InChIKey	QDFWPKAUAWTBTL-UHFFFAOYSA-N Google Search
Mol Weight	351.49 g/mol
Molecular Formula	C26H25N
Exact Mass	351.1987 g/mol

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SpectraBase Spectrum ID	GSw3f9U7kd6
Name	3-([1,1'-Biphenyl]-4-yl)-4-n-butyl-1-methylisoquinoline
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C26H25N
InChI	InChI=1S/C26H25N/c1-3-4-12-25-24-14-9-8-13-23(24)19(2)27-26(25)22-17-15-21(16-18-22)20-10-6-5-7-11-20/h5-11,13-18H,3-4,12H2,1-2H3
InChIKey	QDFWPKAUAWTBTL-UHFFFAOYSA-N
Literature Reference DOI	10.1021/jo301768b
Molecular Weight	351.493 g/mol
SMILES	c1cccc2c(c(nc(c12)C)-c1ccc(cc1)-c1ccccc1)CCCC
SPLASH	splash10-0ab9-0009000000-699aef6b7b8313f6e7a8
Source of Spectrum	J-77-9196-3al
Synonyms	3-([1,1'-biphenyl]-4-yl)-4-butyl-1-methylisoquinoline
Wiley ID	1747132