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(1R,2S)-1-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2-[(4R,5R)-4,5-diphenyl-2-isoxazolin-3-yl]-2-methylsulfinyl-ethanol
SpectraBase Compound ID 68D4yYJz0dw
InChI InChI=1S/C23H27NO5S/c1-23(2)27-14-17(28-23)20(25)22(30(3)26)19-18(15-10-6-4-7-11-15)21(29-24-19)16-12-8-5-9-13-16/h4-13,17-18,20-22,25H,14H2,1-3H3/t17-,18-,20-,21+,22+,30?/m1/s1
InChIKey TZZTXVXPHVEQBT-FBAPWANYSA-N
Mol Weight 429.53 g/mol
Molecular Formula C23H27NO5S
Exact Mass 429.160994 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EKALrh0Yu0
Name (1R,2S)-1-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2-[(4R,5R)-4,5-diphenyl-2-isoxazolin-3-yl]-2-methylsulfinyl-ethanol
Alternate Name(s) (1R,2S)-1-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2-[(4R,5R)-4,5-diphenyl-4,5-dihydro-1,2-oxazol-3-yl]-2-methylsulfinyl-ethanol (1R,2S)-1-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2-[(4R,5R)-4,5-diphenyl-4,5-dihydroisoxazol-3-yl]-2-methylsulfinyl-ethanol (1R,2S)-1-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2-[(4R,5R)-4,5-diphenyl-4,5-dihydroisoxazol-3-yl]-2-methylsulfinylethanol
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Formula C23H27NO5S
InChI InChI=1S/C23H27NO5S/c1-23(2)27-14-17(28-23)20(25)22(30(3)26)19-18(15-10-6-4-7-11-15)21(29-24-19)16-12-8-5-9-13-16/h4-13,17-18,20-22,25H,14H2,1-3H3/t17-,18-,20-,21+,22+,30?/m1/s1
InChIKey TZZTXVXPHVEQBT-FBAPWANYSA-N
Molecular Weight 429.531 g/mol
SMILES O[C@@]([C@](C1=NO[C@]([C@@]1(c1ccccc1)[H])(c1ccccc1)[H])(S(=O)C)[H])([C@@]1(OC(C)(C)OC1)[H])[H]
SPLASH splash10-0gbc-6791100000-d08760e5bf3fcb2a9480
Source of Spectrum QC-11-4800-18
Wiley ID 860273