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N-[5'-Acetyl-6-(methylthio)-2'-phenylpyrimidin-4'-yl]-O-(methylacetimidate)
SpectraBase Compound ID Fdzk1PWfOiy
InChI InChI=1S/C16H17N3O2S/c1-10(20)13-15(17-11(2)21-3)18-14(19-16(13)22-4)12-8-6-5-7-9-12/h5-9H,1-4H3/b17-11+
InChIKey KNEYCPWKDZACBW-GZTJUZNOSA-N
Mol Weight 315.39 g/mol
Molecular Formula C16H17N3O2S
Exact Mass 315.104148 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CQ2ofIF55Hp
Name N-[5'-Acetyl-6-(methylthio)-2'-phenylpyrimidin-4'-yl]-O-(methylacetimidate)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H17N3O2S
InChI InChI=1S/C16H17N3O2S/c1-10(20)13-15(17-11(2)21-3)18-14(19-16(13)22-4)12-8-6-5-7-9-12/h5-9H,1-4H3/b17-11+
InChIKey KNEYCPWKDZACBW-GZTJUZNOSA-N
Molecular Weight 315.391 g/mol
SMILES c1(nc(-c2ccccc2)nc(c1C(=O)C)SC)\N=C/(OC)C
SPLASH splash10-0ue9-0059000000-573884ca6205ae404c2f
Source of Spectrum F9-1995-1327-11
Synonyms Methyl (1E)-N-[5-acetyl-6-(methylsulfanyl)-2-phenyl-4-pyrimidinyl]ethanimidoate N-[5'-Acetyl-6'-(methylthio)-2'-phenylpyrimidin-4'-yl]-(methylacetyl)-imidate N-[5-Acetyl-6-(methylthio)-2-phenylpyrimidin-4-yl]-acetimidic acid methyl ester
Wiley ID 1567007