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Carbamic acid, [2,3,4,5,6,7-hexahydro-1,3-dimethyl-2,4,6-trioxo-5-(trifluoromethyl)-1H-pyrrolo[2,3-d]pyrimidin-5-yl]-, methyl ester
SpectraBase Compound ID LqZ6a6UTJOh
InChI InChI=1S/C11H11F3N4O5/c1-17-5-4(6(19)18(2)9(17)22)10(7(20)15-5,11(12,13)14)16-8(21)23-3/h1-3H3,(H,15,20)(H,16,21)
InChIKey SCSHDMCVKBOOAS-UHFFFAOYSA-N
Mol Weight 336.23 g/mol
Molecular Formula C11H11F3N4O5
Exact Mass 336.068154 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B5NSNirdxdT
Name Carbamic acid, [2,3,4,5,6,7-hexahydro-1,3-dimethyl-2,4,6-trioxo-5-(trifluoromethyl)-1H-pyrrolo[2,3-d]pyrimidin-5-yl]-, methyl ester
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Formula C11H11F3N4O5
InChI InChI=1S/C11H11F3N4O5/c1-17-5-4(6(19)18(2)9(17)22)10(7(20)15-5,11(12,13)14)16-8(21)23-3/h1-3H3,(H,15,20)(H,16,21)
InChIKey SCSHDMCVKBOOAS-UHFFFAOYSA-N
Molecular Weight 336.227 g/mol
SMILES N1C(C(C=2C(N(C(N(C12)C)=O)C)=O)(C(F)(F)F)NC(=O)OC)=O
SPLASH splash10-00kr-6691000000-65d5da351e5d7ea4159d
Source of Spectrum IY-2-5051-1
Synonyms Methyl N-[1,3-dimethyl-2,4,6-trioxo-5-(trifluoromethyl)-1H,2H,3H,4H,5H,6H,7H-pyrrolo[2,3-d]pyrimidin-5-yl]carbamate N-[1,3-dimethyl-2,4,6-trioxo-5-(trifluoromethyl)-7H-pyrrolo[2,3-d]pyrimidin-5-yl]carbamic acid methyl ester Methyl N-[1,3-dimethyl-2,4,6-trioxo-5-(trifluoromethyl)-7H-pyrrolo[2,3-d]pyrimidin-5-yl]carbamate Methyl N-[1,3-dimethyl-2,4,6-tris(oxidanylidene)-5-(trifluoromethyl)-7H-pyrrolo[2,3-d]pyrimidin-5-yl]carbamate
Wiley ID 1658494