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(2R)-4,4,4-trifluoro-2-mercapto-butyric acid
SpectraBase Compound ID J0LkzwjGhqB
InChI InChI=1S/C4H5F3O2S/c5-4(6,7)1-2(10)3(8)9/h2,10H,1H2,(H,8,9)/t2-/m1/s1
InChIKey LZMRDPVKOKJNME-UWTATZPHSA-N
Mol Weight 174.14 g/mol
Molecular Formula C4H5F3O2S
Exact Mass 173.996235 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8akj3lM9TfK
Name (2R)-4,4,4-trifluoro-2-mercapto-butyric acid
Alternate Name(s) (2R)-4,4,4-trifluoro-2-mercaptobutanoic acid (2R)-4,4,4-trifluoro-2-sulfanyl-butanoic acid (2R)-4,4,4-tris(fluoranyl)-2-sulfanyl-butanoic acid
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Formula C4H5F3O2S
InChI InChI=1S/C4H5F3O2S/c5-4(6,7)1-2(10)3(8)9/h2,10H,1H2,(H,8,9)/t2-/m1/s1
InChIKey LZMRDPVKOKJNME-UWTATZPHSA-N
Molecular Weight 174.137 g/mol
SMILES OC([C@@](CC(F)(F)F)(S)[H])=O
SPLASH splash10-05dl-6900000000-622fa8701f75e3f70a50
Source of Spectrum QC-11-2130-6
Wiley ID 859911