CID 172774

71317-41-4

Structural Information

Molecular Formula

C₂₄H₅₀O₄S

SMILES

CCCCCCCCCCCCCCCCCCCCCCCCOS(=O)(=O)O

InChI

InChI=1S/C24H50O4S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-28-29(25,26)27/h2-24H2,1H3,(H,25,26,27)

InChIKey

OXYOPNBYVLUFAF-UHFFFAOYSA-N

Compound name

tetracosyl hydrogen sulfate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 241
Patents: 434.343 Da
Monoisotopic Mass: 11.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	435.35028	214.6
[M+Na]+	457.33222	219.0
[M+NH4]+	452.37682	222.1
[M+K]+	473.30616	209.4
[M-H]-	433.33572	210.8
[M+Na-2H]-	455.31767	211.7
[M]+	434.34245	214.2
[M]-	434.34355	214.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe