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2-(4'-Chloro-8'-methylquinolin-2'-yl)-5,7-bis(t-butyl)-1,3-tropolone
SpectraBase Compound ID DNXzOvQMsNS
InChI InChI=1S/C25H28ClNO2/c1-14-9-8-10-16-18(26)13-19(27-22(14)16)21-20(28)12-15(24(2,3)4)11-17(23(21)29)25(5,6)7/h8-13,21H,1-7H3
InChIKey RUVUZULOWMSFLG-UHFFFAOYSA-N
Mol Weight 409.96 g/mol
Molecular Formula C25H28ClNO2
Exact Mass 409.180857 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GGMhjBWDF1A
Name 2-(4'-Chloro-8'-methylquinolin-2'-yl)-5,7-bis(t-butyl)-1,3-tropolone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H28ClNO2
InChI InChI=1S/C25H28ClNO2/c1-14-9-8-10-16-18(26)13-19(27-22(14)16)21-20(28)12-15(24(2,3)4)11-17(23(21)29)25(5,6)7/h8-13,21H,1-7H3
InChIKey RUVUZULOWMSFLG-UHFFFAOYSA-N
Molecular Weight 409.957 g/mol
SMILES C1(C(c2nc3c(cccc3c(c2)Cl)C)C(C=C(C=C1C(C)(C)C)C(C)(C)C)=O)=O
SPLASH splash10-00lr-2009000000-f990d3fd3fae8ea38f77
Source of Spectrum MN-2003-220-3
Wiley ID 1546604