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2-[(5,5-dimethyl-6-oxo-3-phenyl-2-imidazo[1,2-b][1,2,4]triazolyl)thio]acetic acid ethyl ester
SpectraBase Compound ID zQvRPOBzTT
InChI InChI=1S/C16H18N4O3S/c1-4-23-12(21)10-24-15-18-20-13(22)16(2,3)17-14(20)19(15)11-8-6-5-7-9-11/h5-9H,4,10H2,1-3H3
InChIKey QVPRJYQUJOBSQB-UHFFFAOYSA-N
Mol Weight 346.41 g/mol
Molecular Formula C16H18N4O3S
Exact Mass 346.109962 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2RmmHLs1IHw
Name 2-[(5,5-dimethyl-6-oxo-3-phenyl-2-imidazo[1,2-b][1,2,4]triazolyl)thio]acetic acid ethyl ester
Alternate Name(s) 2-[(6-keto-5,5-dimethyl-3-phenyl-imidazo[1,2-b][1,2,4]triazol-2-yl)thio]acetic acid ethyl ester Ethyl 2-(5,5-dimethyl-6-oxidanylidene-3-phenyl-imidazo[1,2-b][1,2,4]triazol-2-yl)sulfanylethanoate Ethyl 2-(5,5-dimethyl-6-oxo-3-phenyl-imidazo[1,2-b][1,2,4]triazol-2-yl)sulfanylacetate
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Formula C16H18N4O3S
InChI InChI=1S/C16H18N4O3S/c1-4-23-12(21)10-24-15-18-20-13(22)16(2,3)17-14(20)19(15)11-8-6-5-7-9-11/h5-9H,4,10H2,1-3H3
InChIKey QVPRJYQUJOBSQB-UHFFFAOYSA-N
Molecular Weight 346.405 g/mol
SMILES C=12N(N=C(N2c2ccccc2)SCC(=O)OCC)C(C(N1)(C)C)=O
SPLASH splash10-014i-0029000000-eaca38cf6f399ff72d35
Source of Spectrum K1-0-4174-16
Wiley ID 1589507