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(2S,5S)-2-tert-butyl-5-[5-(chloromethyl)-2-iodo-4-methoxy-benzyl]-4-keto-3-methyl-imidazolidine-1-carboxylic acid tert-butyl ester
SpectraBase Compound ID 9lj8Upb18v1
InChI InChI=1S/C22H32ClIN2O4/c1-21(2,3)19-25(7)18(27)16(26(19)20(28)30-22(4,5)6)10-13-9-14(12-23)17(29-8)11-15(13)24/h9,11,16,19H,10,12H2,1-8H3/t16-,19-/m0/s1
InChIKey GIYZWNCTCXIQPK-LPHOPBHVSA-N
Mol Weight 550.9 g/mol
Molecular Formula C22H32ClIN2O4
Exact Mass 550.10953 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LmbrMqDSbc7
Name (2S,5S)-2-tert-butyl-5-[5-(chloromethyl)-2-iodo-4-methoxy-benzyl]-4-keto-3-methyl-imidazolidine-1-carboxylic acid tert-butyl ester
Alternate Name(s) (2S,5S)-2-tert-butyl-5-[[5-(chloromethyl)-2-iodo-4-methoxyphenyl]methyl]-3-methyl-4-oxo-1-imidazolidinecarboxylic acid tert-butyl ester tert-Butyl (2S,5S)-2-tert-butyl-5-[[5-(chloromethyl)-2-iodanyl-4-methoxy-phenyl]methyl]-3-methyl-4-oxidanylidene-imidazolidine-1-carboxylate tert-Butyl (2S,5S)-2-tert-butyl-5-[[5-(chloromethyl)-2-iodo-4-methoxy-phenyl]methyl]-3-methyl-4-oxo-imidazolidine-1-carboxylate
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Formula C22H32ClIN2O4
InChI InChI=1S/C22H32ClIN2O4/c1-21(2,3)19-25(7)18(27)16(26(19)20(28)30-22(4,5)6)10-13-9-14(12-23)17(29-8)11-15(13)24/h9,11,16,19H,10,12H2,1-8H3/t16-,19-/m0/s1
InChIKey GIYZWNCTCXIQPK-LPHOPBHVSA-N
Molecular Weight 550.865 g/mol
SMILES [C@@]1(N([C@](C(N1C)=O)(Cc1c(cc(c(c1)CCl)OC)I)[H])C(OC(C)(C)C)=O)(C(C)(C)C)[H]
SPLASH splash10-0a4l-4139700000-82b04719bbda95fe487c
Source of Spectrum AJ-73-422-33
Wiley ID 775326