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isopropyl 3-[(4-amino-6-oxo-1H-pyrimidin-2-yl)sulfanyl]propanoate
SpectraBase Compound ID C8OGfPbTubT
InChI InChI=1S/C10H15N3O3S/c1-6(2)16-9(15)3-4-17-10-12-7(11)5-8(14)13-10/h5-6H,3-4H2,1-2H3,(H3,11,12,13,14)
InChIKey YQHDXIAVKRWQNV-UHFFFAOYSA-N
Mol Weight 257.31 g/mol
Molecular Formula C10H15N3O3S
Exact Mass 257.083413 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B6iYdSC3z8D
Name isopropyl 3-[(4-amino-6-oxo-1H-pyrimidin-2-yl)sulfanyl]propanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H15N3O3S
InChI InChI=1S/C10H15N3O3S/c1-6(2)16-9(15)3-4-17-10-12-7(11)5-8(14)13-10/h5-6H,3-4H2,1-2H3,(H3,11,12,13,14)
InChIKey YQHDXIAVKRWQNV-UHFFFAOYSA-N
Molecular Weight 257.308 g/mol
SMILES NC=1N=C(SCCC(=O)OC(C)C)NC(C1)=O
SPLASH splash10-00xu-1900000000-d84355d2d00e66e11501
Source of Spectrum RCM-17-1919-12
Synonyms isopropyl 3-((4-amino-6-oxo-1,6-dihydropyrimidin-2-yl)thio)propanoate
Wiley ID 1819889