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6-Amino-2-[(4-methoxybenzyl)sulfanyl]-4-pyrimidinol
SpectraBase Compound ID C4wnMPxC7LH
InChI InChI=1S/C12H13N3O2S/c1-17-9-4-2-8(3-5-9)7-18-12-14-10(13)6-11(16)15-12/h2-6H,7H2,1H3,(H3,13,14,15,16)
InChIKey LNIDSBAQPOYYHJ-UHFFFAOYSA-N
Mol Weight 263.31 g/mol
Molecular Formula C12H13N3O2S
Exact Mass 263.072848 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EZak12MYEmx
Name 6-Amino-2-[(4-methoxybenzyl)sulfanyl]-4-pyrimidinol
CAS Registry Number 166751-38-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H13N3O2S
InChI InChI=1S/C12H13N3O2S/c1-17-9-4-2-8(3-5-9)7-18-12-14-10(13)6-11(16)15-12/h2-6H,7H2,1H3,(H3,13,14,15,16)
InChIKey LNIDSBAQPOYYHJ-UHFFFAOYSA-N
Molecular Weight 263.315 g/mol
SMILES Nc1cc(nc(n1)SCc1ccc(cc1)OC)O
SPLASH splash10-00di-5920000000-46cc6c9b7d8e30d43457
Synonyms 6-Amino-2-(4-methoxy-benzylsulfanyl)-pyrimidin-4-ol 6-Amino-2-(p-anisylthio)-1H-pyrimidin-4-one 6-Amino-2-[(4-methoxyphenyl)methylsulfanyl]-1H-pyrimidin-4-one 6-Amino-2-[(4-methoxyphenyl)methylthio]-1H-pyrimidin-4-one 6-Azanyl-2-[(4-methoxyphenyl)methylsulfanyl]-1H-pyrimidin-4-one
Wiley ID 1460999