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Ethyl ([4-chloro-6-(4-iodoanilino)-1,3,5-triazin-2-yl]amino)acetate
SpectraBase Compound ID XFrKlwh0sQ
InChI InChI=1S/C13H13ClIN5O2/c1-2-22-10(21)7-16-12-18-11(14)19-13(20-12)17-9-5-3-8(15)4-6-9/h3-6H,2,7H2,1H3,(H2,16,17,18,19,20)
InChIKey HPZFWDCPVYRSNA-UHFFFAOYSA-N
Mol Weight 433.64 g/mol
Molecular Formula C13H13ClIN5O2
Exact Mass 432.980247 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5sxOLRnxouC
Name Ethyl ([4-chloro-6-(4-iodoanilino)-1,3,5-triazin-2-yl]amino)acetate
Alternate Name(s) 2-[[4-chloro-6-(4-iodoanilino)-1,3,5-triazin-2-yl]amino]acetic acid ethyl ester 2-[[4-chloro-6-(4-iodoanilino)-s-triazin-2-yl]amino]acetic acid ethyl ester Ethyl 2-[[4-chloranyl-6-[(4-iodophenyl)amino]-1,3,5-triazin-2-yl]amino]ethanoate Ethyl 2-[[4-chloro-6-(4-iodoanilino)-1,3,5-triazin-2-yl]amino]acetate [4-Chloro-6-(4-iodo-phenylamino)-[1,3,5]triazin-2-ylamino]-acetic acid ethyl ester
CAS Registry Number 296244-15-0
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Formula C13H13ClIN5O2
InChI InChI=1S/C13H13ClIN5O2/c1-2-22-10(21)7-16-12-18-11(14)19-13(20-12)17-9-5-3-8(15)4-6-9/h3-6H,2,7H2,1H3,(H2,16,17,18,19,20)
InChIKey HPZFWDCPVYRSNA-UHFFFAOYSA-N
Molecular Weight 433.637 g/mol
SMILES N(c1nc(nc(n1)Cl)Nc1ccc(I)cc1)CC(OCC)=O
SPLASH splash10-01q9-5597800000-4acfb629c677b067d98b
Wiley ID 1459353