CID 108619

Pentadecene-1-sulfonic acid, sodium salt

Structural Information

Molecular Formula
C15H30O3S
SMILES
C=CCCCCCCCCCCCCCS(=O)(=O)O
InChI
InChI=1S/C15H30O3S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19(16,17)18/h2H,1,3-15H2,(H,16,17,18)
InChIKey
YYQBTZFGQLUUHP-UHFFFAOYSA-N
Compound name
pentadec-14-ene-1-sulfonic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

290.19156 Da
Monoisotopic Mass

5.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 291.19884 174.0
[M+Na]+ 313.18078 180.8
[M+NH4]+ 308.22538 179.0
[M+K]+ 329.15472 172.5
[M-H]- 289.18428 170.9
[M+Na-2H]- 311.16623 173.4
[M]+ 290.19101 174.2
[M]- 290.19211 174.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.