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1,4-Methanonaphthalene-5,8-dione, 1,2,3,4-tetrahydro-6-methyl-7-(octadecylamino)-
SpectraBase Compound ID FFRJOKLGfsv
InChI InChI=1S/C30H49NO2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-31-28-23(2)29(32)26-24-19-20-25(22-24)27(26)30(28)33/h24-25,31H,3-22H2,1-2H3/t24-,25+/m1/s1
InChIKey FAJJLKMIEDEIFM-RPBOFIJWSA-N
Mol Weight 455.7 g/mol
Molecular Formula C30H49NO2
Exact Mass 455.37633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HJyn2Atx1al
Name 1,4-Methanonaphthalene-5,8-dione, 1,2,3,4-tetrahydro-6-methyl-7-(octadecylamino)-
Alternate Name(s) (1S,4R)-6-methyl-7-(octadecylamino)-1,2,3,4-tetrahydro-1,4-methanonaphthalene-5,8-dione 6-Methyl-7-(octadecylamino)-1,2,3,4-tetrahydro-1,4-methanonaphthalene-5,8-dione
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Formula C30H49NO2
InChI InChI=1S/C30H49NO2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-31-28-23(2)29(32)26-24-19-20-25(22-24)27(26)30(28)33/h24-25,31H,3-22H2,1-2H3/t24-,25+/m1/s1
InChIKey FAJJLKMIEDEIFM-RPBOFIJWSA-N
Molecular Weight 455.727 g/mol
SMILES N(CCCCCCCCCCCCCCCCCC)C1=C(C(C2=C(C1=O)[C@]1(CC[C@@]2(C1)[H])[H])=O)C
SPLASH splash10-0a4l-9540400000-7b732efc094825be4472
Source of Spectrum JX-2015-4-660
Wiley ID 1726084