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Thimerosal
SpectraBase Compound ID FvFNUaFSguX
InChI InChI=1S/C7H6O2S.C2H5.Hg.Na/c8-7(9)5-3-1-2-4-6(5)10;1-2;;/h1-4,10H,(H,8,9);1H2,2H3;;/q;;2*+1/p-2
InChIKey RTKIYNMVFMVABJ-UHFFFAOYSA-L
Mol Weight 404.81 g/mol
Molecular Formula C9H9HgNaO2S
Exact Mass 405.992739 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Apcl0Z2Gj9k
Name [(o-carboxyphenyl)thio]ethylmercury, sodium salt
Source of Sample Eli Lilly & Company, Indianapolis, Indiana
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Formula C9H9HgNaO2S
InChI InChI=1S/C7H6O2S.C2H5.Hg.Na/c8-7(9)5-3-1-2-4-6(5)10;1-2;;/h1-4,10H,(H,8,9);1H2,2H3;;/q;;2*+1/p-2
InChIKey RTKIYNMVFMVABJ-UHFFFAOYSA-L
Instrument Name Varian A-60
Sadtler NMR Number 7612M
Solvent D2O
Synonyms MERCURY, //O-CARBOXYPHENYL/THIO/- ETHYL-, SODIUM SALT MERTHIOLATE THIMEROSAL BENZOIC ACID, O-//ETHYLMERCURI/- THIO/-, SODIUM SALT