CID 61265

N-butylacetamide

Structural Information

Molecular Formula
C6H13NO
SMILES
CCCCNC(=O)C
InChI
InChI=1S/C6H13NO/c1-3-4-5-7-6(2)8/h3-5H2,1-2H3,(H,7,8)
InChIKey
GYLDXXLJMRTVSS-UHFFFAOYSA-N
Compound name
N-butylacetamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

1
References

2309
Patents

115.09972 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 116.10700 124.9
[M+Na]+ 138.08894 134.5
[M+NH4]+ 133.13354 132.9
[M+K]+ 154.06288 129.2
[M-H]- 114.09244 124.9
[M+Na-2H]- 136.07439 128.8
[M]+ 115.09917 126.0
[M]- 115.10027 126.0
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