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2-(N-methyl8-chloronaphthalene-1-sulfonamido)acetic acid
SpectraBase Compound ID D7LkYAU46XT
InChI InChI=1S/C13H12ClNO4S/c1-15(8-12(16)17)20(18,19)11-7-3-5-9-4-2-6-10(14)13(9)11/h2-7H,8H2,1H3,(H,16,17)
InChIKey JQHASINFKFCSFT-UHFFFAOYSA-N
Mol Weight 313.76 g/mol
Molecular Formula C13H12ClNO4S
Exact Mass 313.017557 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5QbbbFJ4Ytc
Name 2-(N-methyl8-chloronaphthalene-1-sulfonamido)acetic acid
Alternate Name(s) Acetic acid, 2-[[(8-chloro-1-naphthalenyl)sulfonyl]methylamino]- 2-[(8-chloro-1-naphthalenyl)sulfonyl-methylamino]acetic acid 2-[(8-chloronaphthalen-1-yl)sulfonyl-methylamino]acetic acid 2-[(8-chloranylnaphthalen-1-yl)sulfonyl-methyl-amino]ethanoic acid
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Formula C13H12ClNO4S
InChI InChI=1S/C13H12ClNO4S/c1-15(8-12(16)17)20(18,19)11-7-3-5-9-4-2-6-10(14)13(9)11/h2-7H,8H2,1H3,(H,16,17)
InChIKey JQHASINFKFCSFT-UHFFFAOYSA-N
Molecular Weight 313.755 g/mol
SMILES OC(CN(S(c1c2c(Cl)cccc2ccc1)(=O)=O)C)=O
SPLASH splash10-01t9-3950000000-a5538ba27775ec090cc6
Source of Spectrum IY-2-5087-6
Wiley ID 1658859