CID 55264463

2503209-09-2

Structural Information

Molecular Formula
C9H9ClFN
SMILES
C1CC1(C2=C(C=CC(=C2)F)Cl)N
InChI
InChI=1S/C9H9ClFN/c10-8-2-1-6(11)5-7(8)9(12)3-4-9/h1-2,5H,3-4,12H2
InChIKey
BZPSAMQIERFMFI-UHFFFAOYSA-N
Compound name
1-(2-chloro-5-fluorophenyl)cyclopropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

185.04076 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 186.048036 129.4
[M+Na]+ 208.029978 140.8
[M-H]- 184.033484 135.7
[M+NH4]+ 203.074583 146.9
[M+K]+ 224.003918 136.4
[M+H-H2O]+ 168.038020 124.1
[M+HCOO]- 230.038961 149.1
[M+CH3COO]- 244.054611 185.5
[M+Na-2H]- 206.015426 136.3
[M]+ 185.04021142 130.7
[M]- 185.04130858 130.7
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.