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2-Ethoxycarbonylmethylthio-uracil
SpectraBase Compound ID LhMNzGF37Bh
InChI InChI=1S/C8H10N2O3S/c1-2-13-7(12)5-14-8-9-4-3-6(11)10-8/h3-4H,2,5H2,1H3,(H,9,10,11)
InChIKey VSBADAJKYSZMDY-UHFFFAOYSA-N
Mol Weight 214.24 g/mol
Molecular Formula C8H10N2O3S
Exact Mass 214.041213 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ee0STF7gtST
Name Ethyl [(6-oxo-1,6-dihydro-2-pyrimidinyl)sulfanyl]acetate
CAS Registry Number 50892-51-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H10N2O3S
InChI InChI=1S/C8H10N2O3S/c1-2-13-7(12)5-14-8-9-4-3-6(11)10-8/h3-4H,2,5H2,1H3,(H,9,10,11)
InChIKey VSBADAJKYSZMDY-UHFFFAOYSA-N
Molecular Weight 214.239 g/mol
SMILES Oc1nc(SCC(OCC)=O)ncc1
SPLASH splash10-0007-8910000000-4c2599a7b392d5a2aa2f
Source of Spectrum 0-16-222-2
Synonyms 2-Ethoxycarbonylmethylenethiouracil 2-[(6-keto-1H-pyrimidin-2-yl)thio]acetic acid ethyl ester 2-[(6-oxo-1H-pyrimidin-2-yl)thio]acetic acid ethyl ester Ethyl 2-[(6-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]ethanoate Ethyl 2-[(6-oxo-1H-pyrimidin-2-yl)sulfanyl]acetate
Wiley ID 1212997