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Diethyl 2-keto-3(S)-hydroxy-n-butylphosphonate
SpectraBase Compound ID pQVIvwza5T
InChI InChI=1S/C8H17O5P/c1-4-12-14(11,13-5-2)6-8(10)7(3)9/h7,9H,4-6H2,1-3H3/t7-/m0/s1
InChIKey BVDPGUFSHBXHAA-ZETCQYMHSA-N
Mol Weight 224.19 g/mol
Molecular Formula C8H17O5P
Exact Mass 224.081361 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 12xKWRCMReM
Name Diethyl 2-keto-3(S)-hydroxy-n-butylphosphonate
Alternate Name(s) (S)-diethyl (3-hydroxy-2-oxobutyl)phosphonate (3S)-1-diethoxyphosphoryl-3-hydroxy-2-butanone (3S)-1-diethoxyphosphoryl-3-hydroxybutan-2-one (3S)-1-diethoxyphosphoryl-3-oxidanyl-butan-2-one
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Formula C8H17O5P
InChI InChI=1S/C8H17O5P/c1-4-12-14(11,13-5-2)6-8(10)7(3)9/h7,9H,4-6H2,1-3H3/t7-/m0/s1
InChIKey BVDPGUFSHBXHAA-ZETCQYMHSA-N
Literature Reference DOI 10.1002/cjoc.20020201138
Molecular Weight 224.193 g/mol
SMILES O[C@](C(CP(OCC)(OCC)=O)=O)(C)[H]
SPLASH splash10-004i-2900000000-53904912c2abf35afa0f
Source of Spectrum CJC-20-1383-2b
Wiley ID 1774814