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Ethyl 2-(4-(5-bromothiophen-2-yl)-3-phenylthiazol-2(3H)-ylidene)-2-cyanoacetate
SpectraBase Compound ID LpPx5oWBng8
InChI InChI=1S/C18H13BrN2O2S2/c1-2-23-18(22)13(10-20)17-21(12-6-4-3-5-7-12)14(11-24-17)15-8-9-16(19)25-15/h3-9,11H,2H2,1H3
InChIKey MCUWSXCQGVWADY-UHFFFAOYSA-N
Mol Weight 433.34 g/mol
Molecular Formula C18H13BrN2O2S2
Exact Mass 431.960183 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B37P11mWO48
Name Ethyl 2-(4-(5-bromothiophen-2-yl)-3-phenylthiazol-2(3H)-ylidene)-2-cyanoacetate
Appearance Yellowish white powder
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Formula C18H13BrN2O2S2
InChI InChI=1S/C18H13BrN2O2S2/c1-2-23-18(22)13(10-20)17-21(12-6-4-3-5-7-12)14(11-24-17)15-8-9-16(19)25-15/h3-9,11H,2H2,1H3
InChIKey MCUWSXCQGVWADY-UHFFFAOYSA-N
Instrument Name Shimadzu GC-MS-QP 1000 EX
Ionization Type EI
Literature Reference DOI 10.1002/jhet.4122
Molecular Weight 433.338 g/mol
SMILES c1cc(sc1Br)C=1N(C(SC1)=C(C(OCC)=O)C#N)c1ccccc1
SPLASH splash10-000f-9600000000-aad8f0c80fda25583734
Source of Spectrum Y-57-4160-18b
Wiley ID 1859927