CID 68969

593-00-0

Structural Information

Molecular Formula
C5H12FNO
SMILES
C(CN)COCCF
InChI
InChI=1S/C5H12FNO/c6-2-5-8-4-1-3-7/h1-5,7H2
InChIKey
QFTGUVPCABEGDA-UHFFFAOYSA-N
Compound name
3-(2-fluoroethoxy)propan-1-amine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

2
Patents

121.090294 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 122.097570 123.8
[M+Na]+ 144.079512 130.5
[M-H]- 120.083018 122.2
[M+NH4]+ 139.124117 145.7
[M+K]+ 160.053452 130.3
[M+H-H2O]+ 104.087554 118.1
[M+HCOO]- 166.088495 147.5
[M+CH3COO]- 180.104145 172.9
[M+Na-2H]- 142.064960 130.0
[M]+ 121.08974542 123.1
[M]- 121.09084258 123.1
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