CID 105205

Acetamide, 2-(dodecylsulfonyl)-

Structural Information

Molecular Formula
C14H29NO3S
SMILES
CCCCCCCCCCCCS(=O)(=O)CC(=O)N
InChI
InChI=1S/C14H29NO3S/c1-2-3-4-5-6-7-8-9-10-11-12-19(17,18)13-14(15)16/h2-13H2,1H3,(H2,15,16)
InChIKey
AMNDVZSZNQTIAD-UHFFFAOYSA-N
Compound name
2-dodecylsulfonylacetamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

1
References

0
Patents

291.18683 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 292.19411 172.1
[M+Na]+ 314.17605 175.6
[M-H]- 290.17955 170.4
[M+NH4]+ 309.22065 187.4
[M+K]+ 330.14999 172.1
[M+H-H2O]+ 274.18409 165.5
[M+HCOO]- 336.18503 186.8
[M+CH3COO]- 350.20068 203.7
[M+Na-2H]- 312.16150 170.7
[M]+ 291.18628 177.5
[M]- 291.18738 177.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe