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2-(tert-butoxycarbonylamino)-3-chloro-3,3-difluoro-2-hydroxy-propionic acid methyl ester
SpectraBase Compound ID 8sPiucWh9Hg
InChI InChI=1S/C9H14ClF2NO5/c1-7(2,3)18-6(15)13-8(16,5(14)17-4)9(10,11)12/h16H,1-4H3,(H,13,15)
InChIKey JOXPYJKZPYRKJL-UHFFFAOYSA-N
Mol Weight 289.66 g/mol
Molecular Formula C9H14ClF2NO5
Exact Mass 289.052857 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Bu6o6DQfgf8
Name 2-(tert-butoxycarbonylamino)-3-chloro-3,3-difluoro-2-hydroxy-propionic acid methyl ester
Alternate Name(s) 3-Chloro-3,3-difluoro-2-hydroxy-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoic acid methyl ester Methyl 3-chloranyl-3,3-bis(fluoranyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxidanyl-propanoate Methyl 3-chloro-3,3-difluoro-2-hydroxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate
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Formula C9H14ClF2NO5
InChI InChI=1S/C9H14ClF2NO5/c1-7(2,3)18-6(15)13-8(16,5(14)17-4)9(10,11)12/h16H,1-4H3,(H,13,15)
InChIKey JOXPYJKZPYRKJL-UHFFFAOYSA-N
Molecular Weight 289.663 g/mol
SMILES N(C(C(F)(Cl)F)(C(=O)OC)O)C(OC(C)(C)C)=O
SPLASH splash10-0a4i-9050000000-df091162a620c5edab2e
Source of Spectrum J-61-7525-13
Wiley ID 1292391