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(9H-1,3,4,9-Tetraaza-fluoren-2-ylsulfanyl)-acetic acid ethyl ester
SpectraBase Compound ID An7nT3pQruD
InChI InChI=1S/C13H12N4O2S/c1-2-19-10(18)7-20-13-15-12-11(16-17-13)8-5-3-4-6-9(8)14-12/h3-6H,2,7H2,1H3,(H,14,15,17)
InChIKey NLQBFKRQKBPLLA-UHFFFAOYSA-N
Mol Weight 288.32 g/mol
Molecular Formula C13H12N4O2S
Exact Mass 288.068097 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4Zrsw7oceO
Name (9H-1,3,4,9-Tetraaza-fluoren-2-ylsulfanyl)-acetic acid ethyl ester
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Formula C13H12N4O2S
InChI InChI=1S/C13H12N4O2S/c1-2-19-10(18)7-20-13-15-12-11(16-17-13)8-5-3-4-6-9(8)14-12/h3-6H,2,7H2,1H3,(H,14,15,17)
InChIKey NLQBFKRQKBPLLA-UHFFFAOYSA-N
Molecular Weight 288.325 g/mol
SMILES [nH]1c2ccccc2c2c1nc(nn2)SCC(OCC)=O
SPLASH splash10-0hta-5950000000-8aaa9fe5465777083174
Synonyms 2-(5H-[1,2,4]triazino[5,6-b]indol-3-ylthio)acetic acid ethyl ester 2-(5H-[1,2,4]triazin[5,6-b]indol-3-ylthio)acetic acid ethyl ester Ethyl (5H-[1,2,4]triazino[5,6-b]indol-3-ylsulfanyl)acetate Ethyl 2-(5H-[1,2,4]triazino[5,6-b]indol-3-ylsulfanyl)acetate Ethyl 2-(5H-[1,2,4]triazino[5,6-b]indol-3-ylsulfanyl)ethanoate
Wiley ID 1446706