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2-Propoxycarbonylmethylthio-uracil
SpectraBase Compound ID 9emGorEd8Ip
InChI InChI=1S/C9H12N2O3S/c1-2-5-14-8(13)6-15-9-10-4-3-7(12)11-9/h3-4H,2,5-6H2,1H3,(H,10,11,12)
InChIKey UUBMEOCBIMUYGH-UHFFFAOYSA-N
Mol Weight 228.27 g/mol
Molecular Formula C9H12N2O3S
Exact Mass 228.056863 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3EEPf3i38K
Name Propyl [(6-oxo-1,6-dihydro-2-pyrimidinyl)sulfanyl]acetate
CAS Registry Number 79361-43-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H12N2O3S
InChI InChI=1S/C9H12N2O3S/c1-2-5-14-8(13)6-15-9-10-4-3-7(12)11-9/h3-4H,2,5-6H2,1H3,(H,10,11,12)
InChIKey UUBMEOCBIMUYGH-UHFFFAOYSA-N
Molecular Weight 228.266 g/mol
SMILES N1C(=NC=CC1=O)SCC(=O)OCCC
SPLASH splash10-0006-6900000000-49b42329d67be9f8a7b4
Source of Spectrum 0-16-222-3
Synonyms 2-Propoxycarbonylmethylenethiouracil 2-[(6-keto-1H-pyrimidin-2-yl)thio]acetic acid propyl ester 2-[(6-oxo-1H-pyrimidin-2-yl)thio]acetic acid propyl ester Propyl 2-[(6-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]ethanoate Propyl 2-[(6-oxo-1H-pyrimidin-2-yl)sulfanyl]acetate
Wiley ID 1229129