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N-[3-(Methoxymethyl)hept-1-yn-3-yl]-4-bromoaniline
SpectraBase Compound ID FFYLMwKyGo1
InChI InChI=1S/C15H20BrNO/c1-4-6-11-15(5-2,12-18-3)17-14-9-7-13(16)8-10-14/h2,7-10,17H,4,6,11-12H2,1,3H3
InChIKey NFTPIRMXSWIERW-UHFFFAOYSA-N
Mol Weight 310.24 g/mol
Molecular Formula C15H20BrNO
Exact Mass 309.072827 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Cu5PEhPHjKp
Name N-[3-(Methoxymethyl)hept-1-yn-3-yl]-4-bromoaniline
Alternate Name(s) 4-Bromo-N-[1-butyl-1-(methoxymethyl)-2-propynyl]aniline N-(4-bromophenyl)-N-[1-butyl-1-(methoxymethyl)-2-propynyl]amine
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Formula C15H20BrNO
InChI InChI=1S/C15H20BrNO/c1-4-6-11-15(5-2,12-18-3)17-14-9-7-13(16)8-10-14/h2,7-10,17H,4,6,11-12H2,1,3H3
InChIKey NFTPIRMXSWIERW-UHFFFAOYSA-N
Molecular Weight 310.235 g/mol
SMILES N(c1ccc(cc1)Br)C(C#C)(CCCC)COC
SPLASH splash10-02t9-0090000000-4fa27cc67fa2995dd2f4
Source of Spectrum C5-2004-2689-13
Wiley ID 1617497