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

883
Patents

139.07973 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 140.087006 126.5
[M+Na]+ 162.068948 134.2
[M-H]- 138.072454 128.7
[M+NH4]+ 157.113553 147.8
[M+K]+ 178.042888 132.2
[M+H-H2O]+ 122.076990 120.2
[M+HCOO]- 184.077931 149.8
[M+CH3COO]- 198.093581 177.1
[M+Na-2H]- 160.054396 132.0
[M]+ 139.07918142 122.9
[M]- 139.08027858 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