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[4-methyl-3-(piperidine-1-sulfonyl)-benzoylamino]-acetic acid
SpectraBase Compound ID 1NkgToNNO8L
InChI InChI=1S/C15H20N2O5S/c1-11-5-6-12(15(20)16-10-14(18)19)9-13(11)23(21,22)17-7-3-2-4-8-17/h5-6,9H,2-4,7-8,10H2,1H3,(H,16,20)(H,18,19)
InChIKey QTDAFVADFHVPFW-UHFFFAOYSA-N
Mol Weight 340.39 g/mol
Molecular Formula C15H20N2O5S
Exact Mass 340.109293 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EpZCKHmkAZW
Name [4-methyl-3-(piperidine-1-sulfonyl)-benzoylamino]-acetic acid
Alternate Name(s) 2-[(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)carbonylamino]ethanoic acid 2-[(4-methyl-3-piperidin-1-ylsulfonylbenzoyl)amino]acetic acid 2-[(4-methyl-3-piperidinosulfonyl-benzoyl)amino]acetic acid 2-[[4-methyl-3-(1-piperidylsulfonyl)benzoyl]amino]acetic acid 2-[[[4-methyl-3-(1-piperidinylsulfonyl)phenyl]-oxomethyl]amino]acetic acid
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Formula C15H20N2O5S
InChI InChI=1S/C15H20N2O5S/c1-11-5-6-12(15(20)16-10-14(18)19)9-13(11)23(21,22)17-7-3-2-4-8-17/h5-6,9H,2-4,7-8,10H2,1H3,(H,16,20)(H,18,19)
InChIKey QTDAFVADFHVPFW-UHFFFAOYSA-N
Molecular Weight 340.394 g/mol
SMILES N(C(c1cc(S(N2CCCCC2)(=O)=O)c(cc1)C)=O)CC(=O)O
SPLASH splash10-001l-9200000000-3f07521b047dedfbbd36
Wiley ID 1451227