CID 10215328

2-tetradecyloxyethyl sodium sulfate

Structural Information

Molecular Formula
C16H34O5S
SMILES
CCCCCCCCCCCCCCOCCOS(=O)(=O)O
InChI
InChI=1S/C16H34O5S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-20-15-16-21-22(17,18)19/h2-16H2,1H3,(H,17,18,19)
InChIKey
SWPLMYYBIPGCRH-UHFFFAOYSA-N
Compound name
2-tetradecoxyethyl hydrogen sulfate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

293
Patents

338.2127 Da
Monoisotopic Mass

5.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 339.21998 183.6
[M+Na]+ 361.20192 186.5
[M-H]- 337.20542 180.6
[M+NH4]+ 356.24652 197.0
[M+K]+ 377.17586 183.2
[M+H-H2O]+ 321.20996 176.9
[M+HCOO]- 383.21090 197.3
[M+CH3COO]- 397.22655 206.8
[M+Na-2H]- 359.18737 183.1
[M]+ 338.21215 194.1
[M]- 338.21325 194.1
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

patents stripe