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5-[(1S)-1-phenylbutoxy]-3-propyl-2-isoxazoline
SpectraBase Compound ID 6XadxrC35d6
InChI InChI=1S/C16H23NO2/c1-3-8-14-12-16(19-17-14)18-15(9-4-2)13-10-6-5-7-11-13/h5-7,10-11,15-16H,3-4,8-9,12H2,1-2H3/t15-,16?/m0/s1
InChIKey JIHADNHAJABZFY-VYRBHSGPSA-N
Mol Weight 261.36 g/mol
Molecular Formula C16H23NO2
Exact Mass 261.172879 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3mzydhv0ADO
Name 5-[(1S)-1-phenylbutoxy]-3-propyl-2-isoxazoline
Alternate Name(s) 5-[(1S)-1-phenylbutoxy]-3-propyl-4,5-dihydro-1,2-oxazole 5-[(1S)-1-phenylbutoxy]-3-propyl-4,5-dihydroisoxazole
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Formula C16H23NO2
InChI InChI=1S/C16H23NO2/c1-3-8-14-12-16(19-17-14)18-15(9-4-2)13-10-6-5-7-11-13/h5-7,10-11,15-16H,3-4,8-9,12H2,1-2H3/t15-,16?/m0/s1
InChIKey JIHADNHAJABZFY-VYRBHSGPSA-N
Molecular Weight 261.365 g/mol
SMILES C1(ON=C(C1)CCC)O[C@](c1ccccc1)(CCC)[H]
SPLASH splash10-03di-1490000000-55fa91eea76be90c5719
Source of Spectrum KC-0-958-22
Wiley ID 781069