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3,5-Dimethyl-4-[(11'-bromoundecyl)oxy]-1-nitrobenzene
SpectraBase Compound ID Jlqg1QAGtIp
InChI InChI=1S/C19H30BrNO3/c1-16-14-18(21(22)23)15-17(2)19(16)24-13-11-9-7-5-3-4-6-8-10-12-20/h14-15H,3-13H2,1-2H3
InChIKey JTOCKJLTXQNRSQ-UHFFFAOYSA-N
Mol Weight 400.36 g/mol
Molecular Formula C19H30BrNO3
Exact Mass 399.140907 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2YI2SyBeUsn
Name 3,5-Dimethyl-4-[(11'-bromoundecyl)oxy]-1-nitrobenzene
Alternate Name(s) 2-(11-bromoundecoxy)-1,3-dimethyl-5-nitrobenzene 2-(11-bromanylundecoxy)-1,3-dimethyl-5-nitro-benzene
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Formula C19H30BrNO3
InChI InChI=1S/C19H30BrNO3/c1-16-14-18(21(22)23)15-17(2)19(16)24-13-11-9-7-5-3-4-6-8-10-12-20/h14-15H,3-13H2,1-2H3
InChIKey JTOCKJLTXQNRSQ-UHFFFAOYSA-N
Molecular Weight 400.357 g/mol
SMILES c1(N(=O)=O)cc(c(OCCCCCCCCCCCBr)c(c1)C)C
SPLASH splash10-066r-6900100000-ab366b31337f5aa44f52
Source of Spectrum F5-7-1881-10
Wiley ID 1696444