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3-(N-acetyl-4-iodoanilino)benzoic acid ethyl ester
SpectraBase Compound ID L0oWzhSwdEY
InChI InChI=1S/C17H16INO3/c1-3-22-17(21)13-5-4-6-16(11-13)19(12(2)20)15-9-7-14(18)8-10-15/h4-11H,3H2,1-2H3
InChIKey JYVCIZIAACVEPD-UHFFFAOYSA-N
Mol Weight 409.22 g/mol
Molecular Formula C17H16INO3
Exact Mass 409.017488 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GntN4kJiBjm
Name 3-(N-acetyl-4-iodo-anilino)benzoic acid ethyl ester
Comments Less than 3 mono-isotopic peaks
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Formula C17H16INO3
InChI InChI=1S/C17H16INO3/c1-3-22-17(21)13-5-4-6-16(11-13)19(12(2)20)15-9-7-14(18)8-10-15/h4-11H,3H2,1-2H3
InChIKey JYVCIZIAACVEPD-UHFFFAOYSA-N
Molecular Weight 409.223 g/mol
SMILES C(c1cc(ccc1)N(c1ccc(cc1)I)C(=O)C)(=O)OCC
SPLASH splash10-014i-0009400000-e1b6f03d326bef669d4a
Source of Spectrum F-67-7428-3
Synonyms ethyl 3-(N-acetyl-4-iodo-anilino)benzoate ethyl 3-[ethanoyl-(4-iodophenyl)amino]benzoate 3-(N-acetyl-4-iodoanilino)benzoic acid ethyl ester
Wiley ID 1571067