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benzyl N-[(1R)-1-[(3S,5R)-5-(iodomethyl)-2,2-dioxo-1,2.lambda.6-oxathiolan-3-yl]-3-phenylpropyl]carbamate
SpectraBase Compound ID 8mcBwMxD5Zs
InChI InChI=1S/C16H22INO5S/c1-11(2)15(14-8-13(9-17)23-24(14,20)21)18-16(19)22-10-12-6-4-3-5-7-12/h3-7,11,13-15H,8-10H2,1-2H3,(H,18,19)/t13-,14+,15-/m1/s1
InChIKey OKHOPHBGFNJFNG-QLFBSQMISA-N
Mol Weight 467.32 g/mol
Molecular Formula C16H22INO5S
Exact Mass 467.026339 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Gy59Tylubg6
Name benzyl N-[(1R)-1-[(3S,5R)-5-(iodomethyl)-2,2-dioxo-1,2.lambda.6-oxathiolan-3-yl]-3-phenylpropyl]carbamate
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Formula C16H22INO5S
InChI InChI=1S/C16H22INO5S/c1-11(2)15(14-8-13(9-17)23-24(14,20)21)18-16(19)22-10-12-6-4-3-5-7-12/h3-7,11,13-15H,8-10H2,1-2H3,(H,18,19)/t13-,14+,15-/m1/s1
InChIKey OKHOPHBGFNJFNG-QLFBSQMISA-N
Molecular Weight 467.318 g/mol
SMILES N(C(=O)OCc1ccccc1)[C@@]([C@]1(S(O[C@@](CI)(C1)[H])(=O)=O)[H])(C(C)C)[H]
SPLASH splash10-0006-9401200000-2071954a0183807976c6
Source of Spectrum C5-2003-1867-12
Synonyms (S,R,R)-[1-(5-Iodomethyl-2,2-dioxo-2.lammda.6-[1,2]oxathiolan-3-yl)-2-methylpropyl]carbamic acid benzyl ester benzyl (1R)-1-[(3S,5R)-5-(iodomethyl)-2,2-dioxido-1,2-oxathiolan-3-yl]-2-methylpropylcarbamate
Wiley ID 1615845