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2-[(t-Butoxycarbonyl)methylthio]-3-(cyanomethyl)-3,4-dihydro-4-oxothieno[3,2-d]pyrimidine
SpectraBase Compound ID Ezfa4DsPcqp
InChI InChI=1S/C14H15N3O3S2/c1-14(2,3)20-10(18)8-22-13-16-9-4-7-21-11(9)12(19)17(13)6-5-15/h4,7H,6,8H2,1-3H3
InChIKey RXMNKLXHAAYNQE-UHFFFAOYSA-N
Mol Weight 337.41 g/mol
Molecular Formula C14H15N3O3S2
Exact Mass 337.055484 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5wpbM33CiVZ
Name 2-[(t-Butoxycarbonyl)methylthio]-3-(cyanomethyl)-3,4-dihydro-4-oxothieno[3,2-d]pyrimidine
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Formula C14H15N3O3S2
InChI InChI=1S/C14H15N3O3S2/c1-14(2,3)20-10(18)8-22-13-16-9-4-7-21-11(9)12(19)17(13)6-5-15/h4,7H,6,8H2,1-3H3
InChIKey RXMNKLXHAAYNQE-UHFFFAOYSA-N
Molecular Weight 337.412 g/mol
SMILES C=1(N(C(c2c(N1)ccs2)=O)CC#N)SCC(OC(C)(C)C)=O
SPLASH splash10-0a4i-9061000000-6b429c60decbb76b5911
Source of Spectrum Y-38-420-8
Synonyms tert-Butyl {[3-(cyanomethyl)-4-oxo-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetate 2-[[3-(cyanomethyl)-4-oxo-2-thieno[3,2-d]pyrimidinyl]thio]acetic acid tert-butyl ester tert-Butyl 2-[3-(cyanomethyl)-4-oxothieno[3,2-d]pyrimidin-2-yl]sulfanylacetate tert-Butyl 2-[3-(cyanomethyl)-4-oxo-thieno[3,2-d]pyrimidin-2-yl]sulfanylacetate tert-Butyl 2-[3-(cyanomethyl)-4-oxidanylidene-thieno[3,2-d]pyrimidin-2-yl]sulfanylethanoate
Wiley ID 848421