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XRPKKGHVBXCLNH-UHFFFAOYSA-N
SpectraBase Compound ID JMNm7RN4cPz
InChI InChI=1S/C12H10N4O3/c1-3-19-12(18)10(17)9-6-14-11-8(4-13)5-15-16(11)7(9)2/h5-6H,3H2,1-2H3
InChIKey XRPKKGHVBXCLNH-UHFFFAOYSA-N
Mol Weight 258.24 g/mol
Molecular Formula C12H10N4O3
Exact Mass 258.07529 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4aVqLGLZIM3
Name 2-(3-cyano-7-methyl-6-pyrazolo[1,5-a]pyrimidinyl)-2-oxoacetic acid ethyl ester
Alternate Name(s) 2-(3-cyano-7-methyl-pyrazolo[1,5-a]pyrimidin-6-yl)-2-keto-acetic acid ethyl ester Ethyl (3-cyano-7-methylpyrazolo[1,5-a]pyrimidin-6-yl)(oxo)acetate Ethyl 2-(3-cyano-7-methyl-pyrazolo[1,5-a]pyrimidin-6-yl)-2-oxidanylidene-ethanoate Ethyl 2-(3-cyano-7-methyl-pyrazolo[1,5-a]pyrimidin-6-yl)-2-oxo-acetate
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Formula C12H10N4O3
InChI InChI=1S/C12H10N4O3/c1-3-19-12(18)10(17)9-6-14-11-8(4-13)5-15-16(11)7(9)2/h5-6H,3H2,1-2H3
InChIKey XRPKKGHVBXCLNH-UHFFFAOYSA-N
Molecular Weight 258.237 g/mol
SMILES c12[n](C(=C(C=N2)C(C(=O)OCC)=O)C)ncc1C#N
SPLASH splash10-000i-0910000000-c0d5f9223292282a783c
Source of Spectrum KC-0-211-1
Wiley ID 821072