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1,2-Bis(8-acetoxy-3-n-decylquinolin-7-yl)ethane

View entire compound with spectra: 1 MS (GC)

1,2-Bis(8-acetoxy-3-n-decylquinolin-7-yl)ethane
SpectraBase Compound ID 5WZRXfm0M5q
InChI InChI=1S/C44H60N2O4/c1-5-7-9-11-13-15-17-19-21-35-29-39-27-25-37(43(49-33(3)47)41(39)45-31-35)23-24-38-26-28-40-30-36(22-20-18-16-14-12-10-8-6-2)32-46-42(40)44(38)50-34(4)48/h25-32H,5-24H2,1-4H3
InChIKey NSCHDPUURRLVQK-UHFFFAOYSA-N
Mol Weight 681.0 g/mol
Molecular Formula C44H60N2O4
Exact Mass 680.455308 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4s3LaRflnA8
Name 1,2-Bis(8-acetoxy-3-n-decylquinolin-7-yl)ethane
Alternate Name(s) 1,2-Bis(8-hydroxy-3-n-decylquinolin-7-yl)ethane 7-{2-[8-(acetyloxy)-3-decyl-7-quinolinyl]ethyl}-3-decyl-8-quinolinyl acetate
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C44H60N2O4
InChI InChI=1S/C44H60N2O4/c1-5-7-9-11-13-15-17-19-21-35-29-39-27-25-37(43(49-33(3)47)41(39)45-31-35)23-24-38-26-28-40-30-36(22-20-18-16-14-12-10-8-6-2)32-46-42(40)44(38)50-34(4)48/h25-32H,5-24H2,1-4H3
InChIKey NSCHDPUURRLVQK-UHFFFAOYSA-N
Molecular Weight 680.974 g/mol
SMILES C(Cc1ccc2cc(cnc2c1OC(=O)C)CCCCCCCCCC)c1ccc2cc(cnc2c1OC(=O)C)CCCCCCCCCC
SPLASH splash10-0002-0090000000-d497cbf322668935d89b
Source of Spectrum QE-5-54-1
Wiley ID 843963