CID 9757

N-4-fluorobutylacetamide

Structural Information

Molecular Formula
C6H12FNO
SMILES
CC(=O)NCCCCF
InChI
InChI=1S/C6H12FNO/c1-6(9)8-5-3-2-4-7/h2-5H2,1H3,(H,8,9)
InChIKey
OSYIGZSQARXLDX-UHFFFAOYSA-N
Compound name
N-(4-fluorobutyl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

133.09029 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 134.09757 127.6
[M+Na]+ 156.07951 134.1
[M-H]- 132.08301 126.5
[M+NH4]+ 151.12411 149.3
[M+K]+ 172.05345 133.8
[M+H-H2O]+ 116.08755 121.9
[M+HCOO]- 178.08849 150.8
[M+CH3COO]- 192.10414 175.9
[M+Na-2H]- 154.06496 133.0
[M]+ 133.08974 126.9
[M]- 133.09084 126.9
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.