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1-Pyrrolidinecarboxylic acid, 4-hydroxy-3-iodo-2-[(4-methoxyphenyl)methyl]-, phenylmethyl ester, (2.alpha.,3.beta.,4.alpha.)-(.+-.)-

View entire compound with spectra: 1 MS (GC)

1-Pyrrolidinecarboxylic acid, 4-hydroxy-3-iodo-2-[(4-methoxyphenyl)methyl]-, phenylmethyl ester, (2.alpha.,3.beta.,4.alpha.)-(.+-.)-
SpectraBase Compound ID 4aqCNftoU7q
InChI InChI=1S/C20H22INO4/c1-25-16-9-7-14(8-10-16)11-17-19(21)18(23)12-22(17)20(24)26-13-15-5-3-2-4-6-15/h2-10,17-19,23H,11-13H2,1H3/t17-,18-,19-/m1/s1
InChIKey JGOFADDRGPMXDW-GUDVDZBRSA-N
Mol Weight 467.3 g/mol
Molecular Formula C20H22INO4
Exact Mass 467.059353 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3k2AemZM5Ef
Name 1-Pyrrolidinecarboxylic acid, 4-hydroxy-3-iodo-2-[(4-methoxyphenyl)methyl]-, phenylmethyl ester, (2.alpha.,3.beta.,4.alpha.)-(.+-.)-
Alternate Name(s) benzyl (2R,3R,4R)-4-hydroxy-3-iodo-2-(4-methoxybenzyl)-1-pyrrolidinecarboxylate N-((benzyloxy)carbonyl)-4.beta.-hydroxy-3.alpha.-iodo-2.beta.-(p-methoxybenzyl)pyrrolidine
CAS Registry Number 82892-42-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H22INO4
InChI InChI=1S/C20H22INO4/c1-25-16-9-7-14(8-10-16)11-17-19(21)18(23)12-22(17)20(24)26-13-15-5-3-2-4-6-15/h2-10,17-19,23H,11-13H2,1H3/t17-,18-,19-/m1/s1
InChIKey JGOFADDRGPMXDW-GUDVDZBRSA-N
Molecular Weight 467.303 g/mol
SMILES O[C@@]1(CN([C@@]([C@]1(I)[H])(Cc1ccc(cc1)OC)[H])C(OCc1ccccc1)=O)[H]
SPLASH splash10-00dl-7900000000-9da0551076de8400beca
Source of Spectrum C-104-6078-0
Wiley ID 1392137