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3,5-diiodo-4-hydroxybenzoic acid
SpectraBase Compound ID 9SIsJJeGhcg
InChI InChI=1S/C7H4I2O3/c8-4-1-3(7(11)12)2-5(9)6(4)10/h1-2,10H,(H,11,12)
InChIKey XREKTVACBXQCSB-UHFFFAOYSA-N
Mol Weight 389.91 g/mol
Molecular Formula C7H4I2O3
Exact Mass 389.824984 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IuRGo7ivOqL
Name Benzoic acid, 4-hydroxy-3,5-diiodo-
Alternate Name(s) 3,5-bis(iodanyl)-4-oxidanyl-benzoic acid 3,5-Diiodo-4-hydroxybenzoic acid 4-Hydroxy-3,5-diiodo-benzoic acid Benzoic acid, 3,5-diiodo-4-hydroxy- Ioxynil acid AI3-14923 BRN 2212145 EINECS 210-562-0 M AND B 10903 NSC 1497
CAS Registry Number 618-76-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H4I2O3
InChI InChI=1S/C7H4I2O3/c8-4-1-3(7(11)12)2-5(9)6(4)10/h1-2,10H,(H,11,12)
InChIKey XREKTVACBXQCSB-UHFFFAOYSA-N
Molecular Weight 389.915 g/mol
SMILES OC(c1cc(c(c(c1)I)O)I)=O
SPLASH splash10-014i-9000000000-158406ed7c15dc17a251
Source of Spectrum W5-33145-32391-32391
Wiley ID 1364458