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N-{[4-(Methylsulfanyl)-2-oxopyrimidin-1(2H)-yl]acetyl}-L-phenylglycine Methyl Ester
SpectraBase Compound ID A9kqqGfBFCR
InChI InChI=1S/C16H17N3O4S/c1-23-15(21)14(11-6-4-3-5-7-11)17-12(20)10-19-9-8-13(24-2)18-16(19)22/h3-9,14H,10H2,1-2H3,(H,17,20)/t14-/m0/s1
InChIKey AAJKECVGDCEICL-AWEZNQCLSA-N
Mol Weight 347.39 g/mol
Molecular Formula C16H17N3O4S
Exact Mass 347.093977 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HaiuTOazT6x
Name N-{[4-(Methylsulfanyl)-2-oxopyrimidin-1(2H)-yl]acetyl}-L-phenylglycine Methyl Ester
Alternate Name(s) (S)-methyl 2-(2-(4-(methylthio)-2-oxopyrimidin-1(2H)-yl)acetamido)-2-phenylacetate (2S)-2-[[2-[4-(methylthio)-2-oxo-1-pyrimidinyl]-1-oxoethyl]amino]-2-phenylacetic acid methyl ester Methyl (2S)-2-[[2-(4-methylsulfanyl-2-oxopyrimidin-1-yl)acetyl]amino]-2-phenylacetate Methyl (2S)-2-[[2-(4-methylsulfanyl-2-oxo-pyrimidin-1-yl)acetyl]amino]-2-phenyl-acetate Methyl (2S)-2-[2-(4-methylsulfanyl-2-oxidanylidene-pyrimidin-1-yl)ethanoylamino]-2-phenyl-ethanoate
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Formula C16H17N3O4S
InChI InChI=1S/C16H17N3O4S/c1-23-15(21)14(11-6-4-3-5-7-11)17-12(20)10-19-9-8-13(24-2)18-16(19)22/h3-9,14H,10H2,1-2H3,(H,17,20)/t14-/m0/s1
InChIKey AAJKECVGDCEICL-AWEZNQCLSA-N
Molecular Weight 347.389 g/mol
SMILES N([C@](C(=O)OC)(c1ccccc1)[H])C(CN1C(N=C(C=C1)SC)=O)=O
SPLASH splash10-0006-0934000000-890ea2c05617a6558154
Source of Spectrum HC-47-1294-7
Wiley ID 1739492