CID 3051331

Sodium lauryl glyceryl ether sulfonate

Structural Information

Molecular Formula
C15H32O5S2
SMILES
CCCCCCCCCCCCOC[C@@H](COS(=O)(=S)O)O
InChI
InChI=1S/C15H32O5S2/c1-2-3-4-5-6-7-8-9-10-11-12-19-13-15(16)14-20-22(17,18)21/h15-16H,2-14H2,1H3,(H,17,18,21)/t15-/m0/s1
InChIKey
SKLBVENTCWBDHA-HNNXBMFYSA-N
Compound name
(2S)-1-dodecoxy-3-hydroxysulfonothioyloxypropan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

72
Patents

356.16913 Da
Monoisotopic Mass

5.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 357.17641 185.4
[M+Na]+ 379.15835 189.3
[M+NH4]+ 374.20295 189.1
[M+K]+ 395.13229 181.8
[M-H]- 355.16185 180.8
[M+Na-2H]- 377.14380 182.4
[M]+ 356.16858 185.1
[M]- 356.16968 185.1
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.