CID 2782362

1-(3-fluorophenyl)ethanamine

Structural Information

Molecular Formula
C8H10FN
SMILES
CC(C1=CC(=CC=C1)F)N
InChI
InChI=1S/C8H10FN/c1-6(10)7-3-2-4-8(9)5-7/h2-6H,10H2,1H3
InChIKey
ASNVMKIDRJZXQZ-UHFFFAOYSA-N
Compound name
1-(3-fluorophenyl)ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

839
Patents

139.07973 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 140.08701 126.5
[M+Na]+ 162.06895 134.2
[M-H]- 138.07245 128.7
[M+NH4]+ 157.11355 147.8
[M+K]+ 178.04289 132.2
[M+H-H2O]+ 122.07699 120.2
[M+HCOO]- 184.07793 149.8
[M+CH3COO]- 198.09358 177.1
[M+Na-2H]- 160.05440 132.0
[M]+ 139.07918 122.9
[M]- 139.08028 122.9
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

patents stripe