1-Butanesulfonic acid

Systematic / IUPAC Name: 1-Butanesulfonic acid

ID: Reference1721

Other Names: Butane-1-sulfonic acid;
Butanesulfonic acid;
Butane-1-sulphonic acid;
n-Butanesulphonic acid;
n-Butane-1-sulfonic acid

Formula: C4H10O3S

Spectral Data

1-Butanesulfonic acid mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Q Exactive Orbitrap
No. of Spectral Trees 1
No. of Spectra 74
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 12/2/2014 8:57:02 AM
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Identificators

InChI InChI=1S/C4H10O3S/c1-2-3-4-8(5,6)7/h2-4H2,1H3,(H,5,6,7)
InChI Key QDHFHIQKOVNCNC-UHFFFAOYSA-N
Canonical SMILES CCCCS(=O)(=O)O
CAS 16794120
Splash
Other Names Butane-1-sulfonic acid;
Butanesulfonic acid;
Butane-1-sulphonic acid;
n-Butanesulphonic acid;
n-Butane-1-sulfonic acid

In Other Databases

ChEBI CHEBI:61958
PubChem 49935
ChemIDPlus 002386472; 002386541; 005391979
ChemSpider 45294