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(3S)-2-methyl-N-[(1R)-1-phenylbutoxy]-3-hexanamine
SpectraBase Compound ID Gdtqld7inQL
InChI InChI=1S/C17H29NO/c1-5-10-16(14(3)4)18-19-17(11-6-2)15-12-8-7-9-13-15/h7-9,12-14,16-18H,5-6,10-11H2,1-4H3/t16-,17+/m0/s1
InChIKey JXBQXQJENNEVJT-DLBZAZTESA-N
Mol Weight 263.42 g/mol
Molecular Formula C17H29NO
Exact Mass 263.224915 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1074eHETP5M
Name (3S)-2-methyl-N-[(1R)-1-phenylbutoxy]-3-hexanamine
Alternate Name(s) (3S)-2-methyl-N-[(1R)-1-phenylbutoxy]hexan-3-amine [(1S)-1-isopropylbutyl]-[(1R)-1-phenylbutoxy]amine
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Formula C17H29NO
InChI InChI=1S/C17H29NO/c1-5-10-16(14(3)4)18-19-17(11-6-2)15-12-8-7-9-13-15/h7-9,12-14,16-18H,5-6,10-11H2,1-4H3/t16-,17+/m0/s1
InChIKey JXBQXQJENNEVJT-DLBZAZTESA-N
Molecular Weight 263.425 g/mol
SMILES N(O[C@@](c1ccccc1)(CCC)[H])[C@](C(C)C)(CCC)[H]
SPLASH splash10-0006-9200000000-13d278b94643f61d5515
Source of Spectrum KC-0-3448-2
Wiley ID 829529