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(2S,Ss)-2-[(1R)-1-(4-Methoxyphenylamino)-1-thienylmethyl]-1,3-benzoxathiole-3(2H)-oxide
SpectraBase Compound ID D6FDEZ24eXD
InChI InChI=1S/C19H17NO3S2/c1-22-14-10-8-13(9-11-14)20-18(16-6-4-12-24-16)19-23-15-5-2-3-7-17(15)25(19)21/h2-12,18-20H,1H3/t18-,19+,25?/m1/s1
InChIKey MZNYPIZDXWNCHQ-VSVPBVKKSA-N
Mol Weight 371.47 g/mol
Molecular Formula C19H17NO3S2
Exact Mass 371.064986 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DWpctTZeDJA
Name (2S,Ss)-2-[(1R)-1-(4-Methoxyphenylamino)-1-thienylmethyl]-1,3-benzoxathiole-3(2H)-oxide
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Formula C19H17NO3S2
InChI InChI=1S/C19H17NO3S2/c1-22-14-10-8-13(9-11-14)20-18(16-6-4-12-24-16)19-23-15-5-2-3-7-17(15)25(19)21/h2-12,18-20H,1H3/t18-,19+,25?/m1/s1
InChIKey MZNYPIZDXWNCHQ-VSVPBVKKSA-N
Molecular Weight 371.469 g/mol
SMILES N([C@@]([C@@]1(S(c2ccccc2O1)=O)[H])(c1sccc1)[H])c1ccc(cc1)OC
SPLASH splash10-014i-4590000000-d3e522707f9c5fbb4f08
Source of Spectrum U1-2002-3400-4
Wiley ID 1523292