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Ethyl 3-[(octadecanoylamino)methyl]indole-2-carboxylate
SpectraBase Compound ID HwCQc8TqkzO
InChI InChI=1S/C30H48N2O3/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-23-28(33)31-24-26-25-21-19-20-22-27(25)32-29(26)30(34)35-4-2/h19-22,32H,3-18,23-24H2,1-2H3,(H,31,33)
InChIKey NFGZIFSDAPLDBI-UHFFFAOYSA-N
Mol Weight 484.7 g/mol
Molecular Formula C30H48N2O3
Exact Mass 484.366493 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CMbYnYy46p6
Name Ethyl 3-[(octadecanoylamino)methyl]indole-2-carboxylate
Alternate Name(s) ethyl 3-[(stearoylamino)methyl]-1H-indole-2-carboxylate
Comments Less than 3 mono-isotopic peaks
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Formula C30H48N2O3
InChI InChI=1S/C30H48N2O3/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-23-28(33)31-24-26-25-21-19-20-22-27(25)32-29(26)30(34)35-4-2/h19-22,32H,3-18,23-24H2,1-2H3,(H,31,33)
InChIKey NFGZIFSDAPLDBI-UHFFFAOYSA-N
Molecular Weight 484.725 g/mol
SMILES [nH]1c2ccccc2c(CNC(CCCCCCCCCCCCCCCCC)=O)c1C(=O)OCC
SPLASH splash10-0udr-0090600000-bbb7d495af0a182973c6
Source of Spectrum D8-329-390-13
Wiley ID 1516238