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2,2,2-trichloroethyl 8-iodonaphthalene-1-carboxylate
SpectraBase Compound ID 47KtVbcwKlA
InChI InChI=1S/C13H8Cl3IO2/c14-13(15,16)7-19-12(18)9-5-1-3-8-4-2-6-10(17)11(8)9/h1-6H,7H2
InChIKey YSKKZYVWRLAHBX-UHFFFAOYSA-N
Mol Weight 429.47 g/mol
Molecular Formula C13H8Cl3IO2
Exact Mass 427.863458 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LXytvLbgWq9
Name 2,2,2-trichloroethyl 8-iodonaphthalene-1-carboxylate
Alternate Name(s) 2,2,2-tris(chloranyl)ethyl 8-iodanylnaphthalene-1-carboxylate 8-iodo-1-naphthalenecarboxylic acid 2,2,2-trichloroethyl ester 8-iodonaphthalene-1-carboxylic acid 2,2,2-trichloroethyl ester
Comments Less than 3 mono-isotopic peaks
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Formula C13H8Cl3IO2
InChI InChI=1S/C13H8Cl3IO2/c14-13(15,16)7-19-12(18)9-5-1-3-8-4-2-6-10(17)11(8)9/h1-6H,7H2
InChIKey YSKKZYVWRLAHBX-UHFFFAOYSA-N
Molecular Weight 429.468 g/mol
SMILES c1(C(OCC(Cl)(Cl)Cl)=O)c2c(I)cccc2ccc1
SPLASH splash10-001i-0090300000-66e0bf488b8c59a045fb
Source of Spectrum J-62-8818-13
Wiley ID 1380522