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3-Amino-4-[methyl(octadecyl)amino]benzoic acid
SpectraBase Compound ID LsJAOZI4Joy
InChI InChI=1S/C26H46N2O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-28(2)25-20-19-23(26(29)30)22-24(25)27/h19-20,22H,3-18,21,27H2,1-2H3,(H,29,30)
InChIKey KUUQXKLQMIXMMQ-UHFFFAOYSA-N
Mol Weight 418.7 g/mol
Molecular Formula C26H46N2O2
Exact Mass 418.355929 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EGDNUWHQprq
Name 3-Amino-4-[methyl(octadecyl)amino]benzoic acid
Alternate Name(s) 3-Amino-4-[methyl(stearyl)amino]benzoic acid 3-Azanyl-4-[methyl(octadecyl)amino]benzoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H46N2O2
InChI InChI=1S/C26H46N2O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-28(2)25-20-19-23(26(29)30)22-24(25)27/h19-20,22H,3-18,21,27H2,1-2H3,(H,29,30)
InChIKey KUUQXKLQMIXMMQ-UHFFFAOYSA-N
Molecular Weight 418.666 g/mol
SMILES OC(c1ccc(c(c1)N)N(CCCCCCCCCCCCCCCCCC)C)=O
SPLASH splash10-004i-3900200000-56fc4515ea6b12b4d6a4
Source of Spectrum IC-1141-0-0
Wiley ID 1377411