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3-(2,4-diketopyrimidin-1-yl)-3-methoxy-propionic acid methyl ester
SpectraBase Compound ID FFBpAwCJEX8
InChI InChI=1S/C9H12N2O5/c1-15-7(5-8(13)16-2)11-4-3-6(12)10-9(11)14/h3-4,7H,5H2,1-2H3,(H,10,12,14)
InChIKey LXVFPWNTTQLBCI-UHFFFAOYSA-N
Mol Weight 228.2 g/mol
Molecular Formula C9H12N2O5
Exact Mass 228.074621 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1jUC41625EV
Name 3-(2,4-diketopyrimidin-1-yl)-3-methoxy-propionic acid methyl ester
CAS Registry Number 133625-51-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H12N2O5
InChI InChI=1S/C9H12N2O5/c1-15-7(5-8(13)16-2)11-4-3-6(12)10-9(11)14/h3-4,7H,5H2,1-2H3,(H,10,12,14)
InChIKey LXVFPWNTTQLBCI-UHFFFAOYSA-N
Molecular Weight 228.204 g/mol
SMILES N1C(C=CN(C1=O)C(CC(=O)OC)OC)=O
SPLASH splash10-00or-9500000000-12aadd218b2b8588dbf1
Source of Spectrum K-124-2022-6
Synonyms 3-(2,4-dioxo-1-pyrimidinyl)-3-methoxypropanoic acid methyl ester Methyl 3-(2,4-dioxopyrimidin-1-yl)-3-methoxy-propanoate Methyl 3-[2,4-bis(oxidanylidene)pyrimidin-1-yl]-3-methoxy-propanoate
Wiley ID 1229142