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2-Amino-4-methylsulfanylindeno[1,2-d]pyrimidin-5-one
SpectraBase Compound ID 5xCf9oCLm6c
InChI InChI=1S/C12H9N3OS/c1-17-11-8-9(14-12(13)15-11)6-4-2-3-5-7(6)10(8)16/h2-5H,1H3,(H2,13,14,15)
InChIKey RYDRRPOXKSEGSY-UHFFFAOYSA-N
Mol Weight 243.28 g/mol
Molecular Formula C12H9N3OS
Exact Mass 243.046633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1bQppJAnrHX
Name 2-Amino-4-methylsulfanylindeno[1,2-d]pyrimidin-5-one
Appearance Yellow needles
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H9N3OS
InChI InChI=1S/C12H9N3OS/c1-17-11-8-9(14-12(13)15-11)6-4-2-3-5-7(6)10(8)16/h2-5H,1H3,(H2,13,14,15)
InChIKey RYDRRPOXKSEGSY-UHFFFAOYSA-N
Instrument Name JOEL DX-303
Ionization Type EI
Literature Reference DOI 10.1002/jhet.887
Molecular Weight 243.284 g/mol
SMILES Nc1nc(c2C(c3ccccc3-c2n1)=O)SC
SPLASH splash10-0006-0890000000-dfde2ee1317b56ab96e8
Source of Spectrum Y-53-417-3a
Wiley ID 1877681