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Benzeneacetic acid, 4-(chlorosulfonyl)-
SpectraBase Compound ID AAK2G1IRGth
InChI InChI=1S/C8H7ClO4S/c9-14(12,13)7-3-1-6(2-4-7)5-8(10)11/h1-4H,5H2,(H,10,11)
InChIKey FQSSPHAFXLRJBR-UHFFFAOYSA-N
Mol Weight 234.65 g/mol
Molecular Formula C8H7ClO4S
Exact Mass 233.975358 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID PjHAKdPP6
Name Benzeneacetic acid, 4-(chlorosulfonyl)-
Alternate Name(s) 2-(4-(chlorosulfonyl)phenyl)acetic acid [4-(chlorosulfonyl)phenyl]acetic acid 2-(4-Chloranylsulfonylphenyl)ethanoic acid
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Formula C8H7ClO4S
InChI InChI=1S/C8H7ClO4S/c9-14(12,13)7-3-1-6(2-4-7)5-8(10)11/h1-4H,5H2,(H,10,11)
InChIKey FQSSPHAFXLRJBR-UHFFFAOYSA-N
Molecular Weight 234.653 g/mol
SMILES OC(=O)Cc1ccc(cc1)S(Cl)(=O)=O
SPLASH splash10-000j-7910000000-5cfc378a08538c6ac18d
Source of Spectrum JX-2015-1-27
Wiley ID 1720891