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2,5-Cyclohexadiene-1,4-dione, 2,5-bis(aminomethyl)-3-(2,6,10,14-tetramethylhexadecyl)-
SpectraBase Compound ID 98f2hoRCX1i
InChI InChI=1S/C28H50N2O2/c1-6-20(2)10-7-11-21(3)12-8-13-22(4)14-9-15-23(5)16-25-26(19-30)27(31)17-24(18-29)28(25)32/h17,20-23H,6-16,18-19,29-30H2,1-5H3
InChIKey FRHHECLDRDQNBY-UHFFFAOYSA-N
Mol Weight 446.7 g/mol
Molecular Formula C28H50N2O2
Exact Mass 446.387229 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7S6ZbXJXU1A
Name 2,5-Cyclohexadiene-1,4-dione, 2,5-bis(aminomethyl)-3-(2,6,10,14-tetramethylhexadecyl)-
CAS Registry Number 75083-37-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H50N2O2
InChI InChI=1S/C28H50N2O2/c1-6-20(2)10-7-11-21(3)12-8-13-22(4)14-9-15-23(5)16-25-26(19-30)27(31)17-24(18-29)28(25)32/h17,20-23H,6-16,18-19,29-30H2,1-5H3
InChIKey FRHHECLDRDQNBY-UHFFFAOYSA-N
Molecular Weight 446.720 g/mol
SMILES NCC1=C(C(C(CN)=CC1=O)=O)CC(CCCC(CCCC(CCCC(CC)C)C)C)C
SPLASH splash10-0002-4700900000-305b9503d76c1ba21e22
Source of Spectrum W5-35432-30104-30104
Synonyms 2,5-Bis(aminomethyl)-3-(2,6,10,14-tetramethylhexadecyl)benzo-1,4-quinone 2,5-bis(aminomethyl)-3-(2,6,10,14-tetramethylhexadecyl)-1,4-benzoquinone 2,5-bis(aminomethyl)-3-(2,6,10,14-tetramethylhexadecyl)-p-benzoquinone 2,5-bis(aminomethyl)-3-(2,6,10,14-tetramethylhexadecyl)cyclohexa-2,5-diene-1,4-dione
Wiley ID 1386792