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]+ 186.04804 129.4
[M+Na]+ 208.02998 140.8
[M-H]- 184.03348 135.7
[M+NH4]+ 203.07458 146.9
[M+K]+ 224.00392 136.4
[M+H-H2O]+ 168.03802 124.1
[M+HCOO]- 230.03896 149.1
[M+CH3COO]- 244.05461 185.5
[M+Na-2H]- 206.01543 136.3
[M]+ 185.04021 130.7
[M]- 185.04131 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.