CID 573031

N-[(4-fluorophenyl)methyl]cyclopropanamine

Structural Information

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

2D Structure

compound 2d structure
1
Annotation Hits

2
References

63
Patents

165.09538 Da
Monoisotopic Mass

1.9
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

literature stripe

Patent stripe

patents stripe