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(2S,3S)-2-chloro-3-hydroxy-4-phenylmethoxybutanoic acid ethyl ester
SpectraBase Compound ID DmvfRwUv4TH
InChI InChI=1S/C13H17ClO4/c1-2-18-13(16)12(14)11(15)9-17-8-10-6-4-3-5-7-10/h3-7,11-12,15H,2,8-9H2,1H3/t11-,12-/m0/s1
InChIKey ZZGJSMCNKCVWTO-RYUDHWBXSA-N
Mol Weight 272.73 g/mol
Molecular Formula C13H17ClO4
Exact Mass 272.081537 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BnQlJ980bjZ
Name (2S,3S)-2-chloro-3-hydroxy-4-phenylmethoxybutanoic acid ethyl ester
Alternate Name(s) (2S,3S)-4-benzoxy-2-chloro-3-hydroxy-butyric acid ethyl ester ethyl (2S,3S)-2-chloranyl-3-oxidanyl-4-phenylmethoxy-butanoate ethyl (2S,3S)-2-chloro-3-hydroxy-4-phenylmethoxybutanoate
Comments Less than 3 mono-isotopic peaks
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Formula C13H17ClO4
InChI InChI=1S/C13H17ClO4/c1-2-18-13(16)12(14)11(15)9-17-8-10-6-4-3-5-7-10/h3-7,11-12,15H,2,8-9H2,1H3/t11-,12-/m0/s1
InChIKey ZZGJSMCNKCVWTO-RYUDHWBXSA-N
Molecular Weight 272.728 g/mol
SMILES O[C@]([C@@](C(=O)OCC)(Cl)[H])(COCc1ccccc1)[H]
SPLASH splash10-0006-9000000000-c1702fd898efcd3d6567
Source of Spectrum QC-6-2207-0
Wiley ID 883886