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(2R)-2-phenyl-2-(2-quinolinylthio)acetic acid
SpectraBase Compound ID AHmGTeCkUdi
InChI InChI=1S/C17H13NO2S/c19-17(20)16(13-7-2-1-3-8-13)21-15-11-10-12-6-4-5-9-14(12)18-15/h1-11,16H,(H,19,20)/t16-/m1/s1
InChIKey QUDYIIXWNCAAQA-MRXNPFEDSA-N
Mol Weight 295.36 g/mol
Molecular Formula C17H13NO2S
Exact Mass 295.0667 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K35sthsKu
Name (2R)-2-phenyl-2-(2-quinolinylthio)acetic acid
Alternate Name(s) (2R)-2-phenyl-2-(2-quinolylsulfanyl)acetic acid (2R)-2-phenyl-2-(2-quinolylthio)acetic acid (2R)-2-phenyl-2-quinolin-2-ylsulfanyl-ethanoic acid (2R)-2-phenyl-2-quinolin-2-ylsulfanylacetic acid
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Formula C17H13NO2S
InChI InChI=1S/C17H13NO2S/c19-17(20)16(13-7-2-1-3-8-13)21-15-11-10-12-6-4-5-9-14(12)18-15/h1-11,16H,(H,19,20)/t16-/m1/s1
InChIKey QUDYIIXWNCAAQA-MRXNPFEDSA-N
Molecular Weight 295.356 g/mol
SMILES OC([C@](Sc1nc2c(cc1)cccc2)(c1ccccc1)[H])=O
SPLASH splash10-0a4i-0390000000-4a7fefd21150cf13496c
Source of Spectrum U1-2002-1694-8
Wiley ID 1522479