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2281-11-0 molecular structure
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3-(hexadecyldimethylazaniumyl)propane-1-sulfonate

ChemBase ID: 133350
Molecular Formular: C21H45NO3S
Molecular Mass: 391.6519
Monoisotopic Mass: 391.31201531
SMILES and InChIs

SMILES:
CCCCCCCCCCCCCCCC[N+](C)(C)CCCS(=O)(=O)[O-]
Canonical SMILES:
CCCCCCCCCCCCCCCC[N+](CCCS(=O)(=O)[O-])(C)C
InChI:
InChI=1S/C21H45NO3S/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19-22(2,3)20-18-21-26(23,24)25/h4-21H2,1-3H3
InChIKey:
TUBRCQBRKJXJEA-UHFFFAOYSA-N

Cite this record

CBID:133350 http://www.chembase.cn/molecule-133350.html

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