CID 66026191

{1-[(4-fluorophenyl)methyl]cyclopropyl}methanamine

Structural Information

Molecular Formula
C11H14FN
SMILES
C1CC1(CC2=CC=C(C=C2)F)CN
InChI
InChI=1S/C11H14FN/c12-10-3-1-9(2-4-10)7-11(8-13)5-6-11/h1-4H,5-8,13H2
InChIKey
BMDRIRSWAMBAME-UHFFFAOYSA-N
Compound name
[1-[(4-fluorophenyl)methyl]cyclopropyl]methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

179.11102 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 180.11830 133.9
[M+Na]+ 202.10024 143.2
[M-H]- 178.10374 140.0
[M+NH4]+ 197.14484 150.7
[M+K]+ 218.07418 140.2
[M+H-H2O]+ 162.10828 127.3
[M+HCOO]- 224.10922 157.5
[M+CH3COO]- 238.12487 186.6
[M+Na-2H]- 200.08569 140.9
[M]+ 179.11047 133.7
[M]- 179.11157 133.7
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

No patent data available for this compound.