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1-[(2R,3S,4R)-3,4-Epoxy-N-(methoxycarbonyl)-2-pyrrolidinyl]-5-iodouracil
SpectraBase Compound ID JykxAVKLrcE
InChI InChI=1S/C10H10IN3O5/c1-18-10(17)14-3-5-6(19-5)8(14)13-2-4(11)7(15)12-9(13)16/h2,5-6,8H,3H2,1H3,(H,12,15,16)/t5-,6-,8+/m0/s1
InChIKey JEFQRKRMAILKKK-VMHSAVOQSA-N
Mol Weight 379.11 g/mol
Molecular Formula C10H10IN3O5
Exact Mass 378.966515 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5sW6BrPHSkV
Name 1-[(2R,3S,4R)-3,4-Epoxy-N-(methoxycarbonyl)-2-pyrrolidinyl]-5-iodouracil
Comments Less than 3 mono-isotopic peaks
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Formula C10H10IN3O5
InChI InChI=1S/C10H10IN3O5/c1-18-10(17)14-3-5-6(19-5)8(14)13-2-4(11)7(15)12-9(13)16/h2,5-6,8H,3H2,1H3,(H,12,15,16)/t5-,6-,8+/m0/s1
InChIKey JEFQRKRMAILKKK-VMHSAVOQSA-N
Molecular Weight 379.110 g/mol
SMILES N1C(C(=CN(C1=O)[C@]1([C@@]2([C@]([H])(CN1C(=O)OC)O2)[H])[H])I)=O
SPLASH splash10-0006-0901000000-6be67298550e358dce37
Source of Spectrum U1-2010-6639-39
Synonyms (1R,2R,5S)-2-(5-iodo-2,4-dioxo-1-pyrimidinyl)-6-oxa-3-azabicyclo[3.1.0]hexane-3-carboxylic acid methyl ester methyl (1R,2R,5S)-2-(5-iodo-2,4-dioxopyrimidin-1-yl)-6-oxa-3-azabicyclo[3.1.0]hexane-3-carboxylate methyl (1R,2R,5S)-2-(5-iodo-2,4-dioxo-pyrimidin-1-yl)-6-oxa-3-azabicyclo[3.1.0]hexane-3-carboxylate methyl (1R,2R,5S)-2-[5-iodanyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]-6-oxa-3-azabicyclo[3.1.0]hexane-3-carboxylate
Wiley ID 1664742