CID 243972

N,n-dihexylacetamide

Structural Information

Molecular Formula
C14H29NO
SMILES
CCCCCCN(CCCCCC)C(=O)C
InChI
InChI=1S/C14H29NO/c1-4-6-8-10-12-15(14(3)16)13-11-9-7-5-2/h4-13H2,1-3H3
InChIKey
JFUCOPIALLYRGN-UHFFFAOYSA-N
Compound name
N,N-dihexylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

297
Patents

227.22491 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 228.23219 160.2
[M+Na]+ 250.21413 168.4
[M+NH4]+ 245.25873 167.1
[M+K]+ 266.18807 161.6
[M-H]- 226.21763 160.2
[M+Na-2H]- 248.19958 162.3
[M]+ 227.22436 161.1
[M]- 227.22546 161.1
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