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Methyl 2-[(aminosulfonyl)methyl]benzoate
SpectraBase Compound ID cnXcgJpVoV
InChI InChI=1S/C9H11NO4S/c1-14-9(11)8-5-3-2-4-7(8)6-15(10,12)13/h2-5H,6H2,1H3,(H2,10,12,13)
InChIKey DBOUFTHAEAVMJC-UHFFFAOYSA-N
Mol Weight 229.25 g/mol
Molecular Formula C9H11NO4S
Exact Mass 229.040879 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LoYuonS0h7L
Name Methyl 2-[(aminosulfonyl)methyl]benzoate
Alternate Name(s) 2-(sulfamoylmethyl)benzoic acid methyl ester Methyl 2-(sulfamoylmethyl)benzoate
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Formula C9H11NO4S
InChI InChI=1S/C9H11NO4S/c1-14-9(11)8-5-3-2-4-7(8)6-15(10,12)13/h2-5H,6H2,1H3,(H2,10,12,13)
InChIKey DBOUFTHAEAVMJC-UHFFFAOYSA-N
Molecular Weight 229.250 g/mol
SMILES NS(Cc1c(C(=O)OC)cccc1)(=O)=O
SPLASH splash10-0006-9300000000-cb50c84a8ff0974d2fca
Source of Spectrum O-30-333-10
Wiley ID 1230503