CID 19764

N-dodecylacetamide

Structural Information

Molecular Formula
C14H29NO
SMILES
CCCCCCCCCCCCNC(=O)C
InChI
InChI=1S/C14H29NO/c1-3-4-5-6-7-8-9-10-11-12-13-15-14(2)16/h3-13H2,1-2H3,(H,15,16)
InChIKey
MDYPFOFSXHBHFE-UHFFFAOYSA-N
Compound name
N-dodecylacetamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

1
References

1631
Patents

227.22491 Da
Monoisotopic Mass

5.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 228.23219 162.0
[M+Na]+ 250.21413 165.2
[M-H]- 226.21763 160.9
[M+NH4]+ 245.25873 180.1
[M+K]+ 266.18807 163.1
[M+H-H2O]+ 210.22217 155.7
[M+HCOO]- 272.22311 183.6
[M+CH3COO]- 286.23876 197.4
[M+Na-2H]- 248.19958 163.7
[M]+ 227.22436 165.5
[M]- 227.22546 165.5
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.