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3-(4-nitrophenyl)-5-[(1S)-1-phenylbutoxy]-2-isoxazoline
SpectraBase Compound ID E3IBkY43YSJ
InChI InChI=1S/C19H20N2O4/c1-2-6-18(15-7-4-3-5-8-15)24-19-13-17(20-25-19)14-9-11-16(12-10-14)21(22)23/h3-5,7-12,18-19H,2,6,13H2,1H3/t18-,19?/m0/s1
InChIKey RXLUSAIZDKNGNA-OYKVQYDMSA-N
Mol Weight 340.38 g/mol
Molecular Formula C19H20N2O4
Exact Mass 340.142307 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B1TZBgC7Fwm
Name 3-(4-nitrophenyl)-5-[(1S)-1-phenylbutoxy]-2-isoxazoline
Alternate Name(s) 3-(4-nitrophenyl)-5-[(1S)-1-phenylbutoxy]-4,5-dihydro-1,2-oxazole 3-(4-nitrophenyl)-5-[(1S)-1-phenylbutoxy]-4,5-dihydroisoxazole
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Formula C19H20N2O4
InChI InChI=1S/C19H20N2O4/c1-2-6-18(15-7-4-3-5-8-15)24-19-13-17(20-25-19)14-9-11-16(12-10-14)21(22)23/h3-5,7-12,18-19H,2,6,13H2,1H3/t18-,19?/m0/s1
InChIKey RXLUSAIZDKNGNA-OYKVQYDMSA-N
Molecular Weight 340.379 g/mol
SMILES c1(N(=O)=O)ccc(C2=NOC(C2)O[C@](c2ccccc2)(CCC)[H])cc1
SPLASH splash10-0apu-0900000000-58e7a2238291ee2e35f6
Source of Spectrum KC-0-958-20
Wiley ID 781071