CID 16773956

N-[(3-fluorophenyl)methyl]cyclopropanamine

Structural Information

Molecular Formula
C10H12FN
SMILES
C1CC1NCC2=CC(=CC=C2)F
InChI
InChI=1S/C10H12FN/c11-9-3-1-2-8(6-9)7-12-10-4-5-10/h1-3,6,10,12H,4-5,7H2
InChIKey
RVYCJKKWPAMTIY-UHFFFAOYSA-N
Compound name
N-[(3-fluorophenyl)methyl]cyclopropanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

20
Patents

165.09538 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 166.102656 128.7
[M+Na]+ 188.084598 137.7
[M-H]- 164.088104 135.2
[M+NH4]+ 183.129203 144.4
[M+K]+ 204.058538 134.4
[M+H-H2O]+ 148.092640 121.3
[M+HCOO]- 210.093581 153.6
[M+CH3COO]- 224.109231 184.8
[M+Na-2H]- 186.070046 136.4
[M]+ 165.09483142 128.8
[M]- 165.09592858 128.8
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