CID 17863079

4-fluorobutan-1-amine hydrochloride

Structural Information

Molecular Formula
C4H10FN
SMILES
C(CCF)CN
InChI
InChI=1S/C4H10FN/c5-3-1-2-4-6/h1-4,6H2
InChIKey
CULGXMIWFKMPMB-UHFFFAOYSA-N
Compound name
4-fluorobutan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

148
Patents

91.07973 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 92.087006 116.2
[M+Na]+ 114.068948 123.4
[M-H]- 90.072454 114.9
[M+NH4]+ 109.113553 139.4
[M+K]+ 130.042888 123.0
[M+H-H2O]+ 74.076990 111.0
[M+HCOO]- 136.077931 140.0
[M+CH3COO]- 150.093581 167.9
[M+Na-2H]- 112.054396 123.0
[M]+ 91.07918142 113.7
[M]- 91.08027858 113.7
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