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3-(Tosylamino)-5,5-dimethylhexanoic acid
SpectraBase Compound ID 8S186sn7AU5
InChI InChI=1S/C15H23NO4S/c1-11-5-7-13(8-6-11)21(19,20)16-12(9-14(17)18)10-15(2,3)4/h5-8,12,16H,9-10H2,1-4H3,(H,17,18)
InChIKey MAPRRMKSOYATLI-UHFFFAOYSA-N
Mol Weight 313.41 g/mol
Molecular Formula C15H23NO4S
Exact Mass 313.134779 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2P3UniWFH6
Name 3-(Tosylamino)-5,5-dimethylhexanoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H23NO4S
InChI InChI=1S/C15H23NO4S/c1-11-5-7-13(8-6-11)21(19,20)16-12(9-14(17)18)10-15(2,3)4/h5-8,12,16H,9-10H2,1-4H3,(H,17,18)
InChIKey MAPRRMKSOYATLI-UHFFFAOYSA-N
Molecular Weight 313.412 g/mol
SMILES N(S(c1ccc(cc1)C)(=O)=O)C(CC(=O)O)CC(C)(C)C
SPLASH splash10-0006-7890000000-f0a3515780c6d03cb24b
Source of Spectrum H-79-1211-11
Synonyms 5,5-Dimethyl-3-{[(4-methylphenyl)sulfonyl]amino}hexanoic acid
Wiley ID 1314128