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

15
Patents

165.09538 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 166.10266 128.7
[M+Na]+ 188.08460 137.7
[M-H]- 164.08810 135.2
[M+NH4]+ 183.12920 144.4
[M+K]+ 204.05854 134.4
[M+H-H2O]+ 148.09264 121.3
[M+HCOO]- 210.09358 153.6
[M+CH3COO]- 224.10923 184.8
[M+Na-2H]- 186.07005 136.4
[M]+ 165.09483 128.8
[M]- 165.09593 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