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2-[dimethyl(octyl)ammonio]-1-propanesulfonate
SpectraBase Compound ID gaAnR4Juat
InChI InChI=1S/C13H29NO3S/c1-5-6-7-8-9-10-11-14(3,4)13(2)12-18(15,16)17/h13H,5-12H2,1-4H3
InChIKey CJQSBJKMWALWMO-UHFFFAOYSA-N
Mol Weight 279.44 g/mol
Molecular Formula C13H29NO3S
Exact Mass 279.186815 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CQulTqUYgtD
Name 2-[dimethyl(octyl)ammonio]-1-propanesulfonate
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H29NO3S
InChI InChI=1S/C13H29NO3S/c1-5-6-7-8-9-10-11-14(3,4)13(2)12-18(15,16)17/h13H,5-12H2,1-4H3
InChIKey CJQSBJKMWALWMO-UHFFFAOYSA-N
Molecular Weight 279.439 g/mol
SMILES C(C(C)[N+](C)(C)CCCCCCCC)S(=O)(=O)[O-]
SPLASH splash10-0a4i-0900000000-c70d143be2fcf5df5a84
Source of Spectrum CV-20-2433-5
Synonyms 2-[dimethyl(octyl)azaniumyl]propane-1-sulfonate
Wiley ID 1610470