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(2R,Rs)-N-Benzyloxycarbonyl-1-fluoro-3-[(4-methylphenyl)sulfinyl]-2-propanamine
SpectraBase Compound ID CwDjFwvcVOt
InChI InChI=1S/C18H20FNO3S/c1-14-7-9-17(10-8-14)24(22)13-16(11-19)20-18(21)23-12-15-5-3-2-4-6-15/h2-10,16H,11-13H2,1H3,(H,20,21)/t16-,24?/m1/s1
InChIKey JBWHARWRNYPQHO-YAOANENCSA-N
Mol Weight 349.42 g/mol
Molecular Formula C18H20FNO3S
Exact Mass 349.114793 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2MnJOJLO2Bp
Name (2R,Rs)-N-Benzyloxycarbonyl-1-fluoro-3-[(4-methylphenyl)sulfinyl]-2-propanamine
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Formula C18H20FNO3S
InChI InChI=1S/C18H20FNO3S/c1-14-7-9-17(10-8-14)24(22)13-16(11-19)20-18(21)23-12-15-5-3-2-4-6-15/h2-10,16H,11-13H2,1H3,(H,20,21)/t16-,24?/m1/s1
InChIKey JBWHARWRNYPQHO-YAOANENCSA-N
Molecular Weight 349.420 g/mol
SMILES N(C(=O)OCc1ccccc1)[C@@](C[S@](c1ccc(cc1)C)=O)(CF)[H]
SPLASH splash10-0006-9110000000-6ac4b209fff005f3e41f
Source of Spectrum QC-8-2813-5
Synonyms benzyl (1R)-2-fluoro-1-{[(4-methylphenyl)sulfinyl]methyl}ethylcarbamate N-[(2R)-1-fluoro-3-[(R)-(4-methylphenyl)sulfinyl]propan-2-yl]carbamic acid (phenylmethyl) ester benzyl N-[(2R)-1-fluoro-3-[(R)-(4-methylphenyl)sulfinyl]propan-2-yl]carbamate benzyl N-[(1R)-1-(fluoromethyl)-2-[(R)-p-tolylsulfinyl]ethyl]carbamate (phenylmethyl) N-[(2R)-1-fluoranyl-3-[(R)-(4-methylphenyl)sulfinyl]propan-2-yl]carbamate
Wiley ID 870110