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Methyl 2-[(4-amino-6-oxo-1H-pyrimidin-2-yl)sulfanyl]acetate
SpectraBase Compound ID 1aSRVP2S9RY
InChI InChI=1S/C7H9N3O3S/c1-13-6(12)3-14-7-9-4(8)2-5(11)10-7/h2H,3H2,1H3,(H3,8,9,10,11)
InChIKey NBPCBABACHOUNU-UHFFFAOYSA-N
Mol Weight 215.23 g/mol
Molecular Formula C7H9N3O3S
Exact Mass 215.036462 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EOKupZEgQbr
Name Methyl 2-[(4-amino-6-oxo-1H-pyrimidin-2-yl)sulfanyl]acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H9N3O3S
InChI InChI=1S/C7H9N3O3S/c1-13-6(12)3-14-7-9-4(8)2-5(11)10-7/h2H,3H2,1H3,(H3,8,9,10,11)
InChIKey NBPCBABACHOUNU-UHFFFAOYSA-N
Literature Reference DOI 10.1002/rcm.1122
Molecular Weight 215.227 g/mol
SMILES N1C(C=C(N=C1SCC(OC)=O)N)=O
SPLASH splash10-0ce9-1910000000-d47c90758ef573781af1
Source of Spectrum RCM-17-1919-1
Synonyms Methyl 2-((4-amino-6-oxo-1,6-dihydropyrimidin-2-yl)thio)acetate
Wiley ID 1819897