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(E)-3-[(4S,5R)-5-[(1S)-1-hydroxy-2-iodo-ethyl]-2,2-dimethyl-1,3-dioxolan-4-yl]acrylic acid tert-butyl ester
SpectraBase Compound ID HZHaOD1YugN
InChI InChI=1S/C14H23IO5/c1-13(2,3)19-11(17)7-6-10-12(9(16)8-15)20-14(4,5)18-10/h6-7,9-10,12,16H,8H2,1-5H3/b7-6+/t9-,10+,12-/m1/s1
InChIKey CDTCHJJIOFDWGH-BGTKRCNHSA-N
Mol Weight 398.24 g/mol
Molecular Formula C14H23IO5
Exact Mass 398.059019 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4zTqbR3oVZC
Name (E)-3-[(4S,5R)-5-[(1S)-1-hydroxy-2-iodo-ethyl]-2,2-dimethyl-1,3-dioxolan-4-yl]acrylic acid tert-butyl ester
Alternate Name(s) (E)-3-[(4S,5R)-5-[(1S)-1-hydroxy-2-iodoethyl]-2,2-dimethyl-1,3-dioxolan-4-yl]-2-propenoic acid tert-butyl ester tert-Butyl (E)-3-[(4S,5R)-5-[(1S)-1-hydroxy-2-iodo-ethyl]-2,2-dimethyl-1,3-dioxolan-4-yl]prop-2-enoate tert-Butyl (E)-3-[(4S,5R)-5-[(1S)-2-iodanyl-1-oxidanyl-ethyl]-2,2-dimethyl-1,3-dioxolan-4-yl]prop-2-enoate
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Formula C14H23IO5
InChI InChI=1S/C14H23IO5/c1-13(2,3)19-11(17)7-6-10-12(9(16)8-15)20-14(4,5)18-10/h6-7,9-10,12,16H,8H2,1-5H3/b7-6+/t9-,10+,12-/m1/s1
InChIKey CDTCHJJIOFDWGH-BGTKRCNHSA-N
Molecular Weight 398.237 g/mol
SMILES O[C@@]([C@]1(OC(C)(C)O[C@]1(\C=C\C(OC(C)(C)C)=O)[H])[H])(CI)[H]
SPLASH splash10-0a4i-9111000000-5fe56b23de031721a367
Source of Spectrum F-54-4777-8
Wiley ID 806723