CID 60142861

3-fluoro-n-methylpropan-1-amine

Structural Information

Molecular Formula
C4H10FN
SMILES
CNCCCF
InChI
InChI=1S/C4H10FN/c1-6-4-2-3-5/h6H,2-4H2,1H3
InChIKey
OMMBEQZVNCHVOJ-UHFFFAOYSA-N
Compound name
3-fluoro-N-methylpropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

24
Patents

91.07973 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 92.087006 115.8
[M+Na]+ 114.068948 123.0
[M-H]- 90.072454 115.0
[M+NH4]+ 109.113553 139.3
[M+K]+ 130.042888 122.9
[M+H-H2O]+ 74.076990 110.6
[M+HCOO]- 136.077931 140.2
[M+CH3COO]- 150.093581 168.7
[M+Na-2H]- 112.054396 123.7
[M]+ 91.07918142 114.3
[M]- 91.08027858 114.3
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

patents stripe