CID 508459

2-decylsulfonyl-n-(2-hydroxyethyl)acetamide

Structural Information

Molecular Formula
C14H29NO4S
SMILES
CCCCCCCCCCS(=O)(=O)CC(=O)NCCO
InChI
InChI=1S/C14H29NO4S/c1-2-3-4-5-6-7-8-9-12-20(18,19)13-14(17)15-10-11-16/h16H,2-13H2,1H3,(H,15,17)
InChIKey
OWHVUYAKUGLILF-UHFFFAOYSA-N
Compound name
2-decylsulfonyl-N-(2-hydroxyethyl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

307.18173 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 308.18901 175.0
[M+Na]+ 330.17095 177.9
[M-H]- 306.17445 172.3
[M+NH4]+ 325.21555 189.1
[M+K]+ 346.14489 174.3
[M+H-H2O]+ 290.17899 168.4
[M+HCOO]- 352.17993 189.0
[M+CH3COO]- 366.19558 203.2
[M+Na-2H]- 328.15640 174.4
[M]+ 307.18118 180.8
[M]- 307.18228 180.8
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