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iso-Propyl .alpha.-hydroxy-.alpha.-(2-iodo-4-nitrophenyl)phenylacetate
SpectraBase Compound ID 7gJensff5lY
InChI InChI=1S/C17H16INO5/c1-11(2)24-16(20)17(21,12-6-4-3-5-7-12)14-9-8-13(19(22)23)10-15(14)18/h3-11,21H,1-2H3
InChIKey DBGIBLSXACDHIU-UHFFFAOYSA-N
Mol Weight 441.22 g/mol
Molecular Formula C17H16INO5
Exact Mass 441.007318 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1Xg6MwvuJsi
Name iso-Propyl .alpha.-hydroxy-.alpha.-(2-iodo-4-nitrophenyl)phenylacetate
Alternate Name(s) isopropyl hydroxy(2-iodo-4-nitrophenyl)phenylacetate
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Formula C17H16INO5
InChI InChI=1S/C17H16INO5/c1-11(2)24-16(20)17(21,12-6-4-3-5-7-12)14-9-8-13(19(22)23)10-15(14)18/h3-11,21H,1-2H3
InChIKey DBGIBLSXACDHIU-UHFFFAOYSA-N
Molecular Weight 441.221 g/mol
SMILES OC(C(OC(C)C)=O)(c1c(cc(N(=O)=O)cc1)I)c1ccccc1
SPLASH splash10-0udi-0039000000-a335fe8bcd9774e6cc36
Source of Spectrum KC-61-11961-4
Wiley ID 1631661