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tyrosine, N-[(phenylamino)carbonothioyl]-
SpectraBase Compound ID 49HwOqDiyS8
InChI InChI=1S/C16H16N2O3S/c19-13-8-6-11(7-9-13)10-14(15(20)21)18-16(22)17-12-4-2-1-3-5-12/h1-9,14,19H,10H2,(H,20,21)(H2,17,18,22)
InChIKey MJMJHKHZDLOSLW-UHFFFAOYSA-N
Mol Weight 316.37 g/mol
Molecular Formula C16H16N2O3S
Exact Mass 316.088164 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7iX8o4pJpRU
Name 2-[[anilino(sulfanylidene)methyl]amino]-3-(4-hydroxyphenyl)propanoic acid
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Formula C16H16N2O3S
InChI InChI=1S/C16H16N2O3S/c19-13-8-6-11(7-9-13)10-14(15(20)21)18-16(22)17-12-4-2-1-3-5-12/h1-9,14,19H,10H2,(H,20,21)(H2,17,18,22)
InChIKey MJMJHKHZDLOSLW-UHFFFAOYSA-N
Molecular Weight 316.375 g/mol
SMILES N(C(Nc1ccccc1)=S)C(Cc1ccc(cc1)O)C(=O)O
SPLASH splash10-0006-0900000000-8301bc5dd99024d7180d
Source of Spectrum AV-53-119-3
Synonyms 3-(4-hydroxyphenyl)-2-(phenylcarbamothioylamino)propanoic acid 3-(4-hydroxyphenyl)-2-(phenylthiocarbamoylamino)propionic acid
Wiley ID 1316575