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(3-iodo-1-methyl-butyl) naphthalene-1-sulfonate
SpectraBase Compound ID 25DZkPe8voM
InChI InChI=1S/C15H17IO3S/c1-11(16)10-12(2)19-20(17,18)15-9-5-7-13-6-3-4-8-14(13)15/h3-9,11-12H,10H2,1-2H3
InChIKey CNOBKTNWHAFMDG-UHFFFAOYSA-N
Mol Weight 404.26 g/mol
Molecular Formula C15H17IO3S
Exact Mass 403.994311 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DjVidbXNBYT
Name (3-iodo-1-methyl-butyl) naphthalene-1-sulfonate
Alternate Name(s) 1-naphthalenesulfonic acid 4-iodopentan-2-yl ester 4-iodanylpentan-2-yl naphthalene-1-sulfonate 4-iodopentan-2-yl naphthalene-1-sulfonate naphthalene-1-sulfonic acid (3-iodo-1-methyl-butyl) ester
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Formula C15H17IO3S
InChI InChI=1S/C15H17IO3S/c1-11(16)10-12(2)19-20(17,18)15-9-5-7-13-6-3-4-8-14(13)15/h3-9,11-12H,10H2,1-2H3
InChIKey CNOBKTNWHAFMDG-UHFFFAOYSA-N
Molecular Weight 404.262 g/mol
SMILES c1(cccc2ccccc12)S(=O)(=O)OC(CC(C)I)C
SPLASH splash10-066r-9360000000-2cdff933e74dfff14848
Source of Spectrum U1-2002-2748-5
Wiley ID 1523009