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Ethyl 4-[5-(3-iodanyl-5-nitro-phenyl)-1,3,4-oxadiazol-2-yl]benzoate
SpectraBase Compound ID 7Yv7DVK0xvr
InChI InChI=1S/C17H12IN3O5/c1-2-25-17(22)11-5-3-10(4-6-11)15-19-20-16(26-15)12-7-13(18)9-14(8-12)21(23)24/h3-9H,2H2,1H3
InChIKey LFNSORWNYDGDBN-UHFFFAOYSA-N
Mol Weight 465.2 g/mol
Molecular Formula C17H12IN3O5
Exact Mass 464.982165 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7KncNMp2q08
Name Ethyl 4-[5-(3-iodanyl-5-nitro-phenyl)-1,3,4-oxadiazol-2-yl]benzoate
Alternate Name(s) Ethyl 4-[5-(3-iodo-5-nitro-phenyl)-1,3,4-oxadiazol-2-yl]benzoate 4-[5-(3-iodo-5-nitrophenyl)-1,3,4-oxadiazol-2-yl]benzoic acid ethyl ester Ethyl 4-[5-(3-iodo-5-nitrophenyl)-1,3,4-oxadiazol-2-yl]benzoate
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Formula C17H12IN3O5
InChI InChI=1S/C17H12IN3O5/c1-2-25-17(22)11-5-3-10(4-6-11)15-19-20-16(26-15)12-7-13(18)9-14(8-12)21(23)24/h3-9H,2H2,1H3
InChIKey LFNSORWNYDGDBN-UHFFFAOYSA-N
Molecular Weight 465.203 g/mol
SMILES c1(oc(-c2ccc(C(=O)OCC)cc2)nn1)-c1cc(N(=O)=O)cc(c1)I
SPLASH splash10-004i-9710200000-bd29637f9537b4962d54
Wiley ID 1442705