CID 55264237

1890151-61-7

Structural Information

Molecular Formula
C9H9F2N
SMILES
C1CC1(C2=C(C(=CC=C2)F)F)N
InChI
InChI=1S/C9H9F2N/c10-7-3-1-2-6(8(7)11)9(12)4-5-9/h1-3H,4-5,12H2
InChIKey
FOKPCNODRMAGMR-UHFFFAOYSA-N
Compound name
1-(2,3-difluorophenyl)cyclopropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

169.07031 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 170.077586 126.3
[M+Na]+ 192.059528 137.4
[M-H]- 168.063034 131.8
[M+NH4]+ 187.104133 143.7
[M+K]+ 208.033468 134.2
[M+H-H2O]+ 152.067570 119.4
[M+HCOO]- 214.068511 149.5
[M+CH3COO]- 228.084161 184.5
[M+Na-2H]- 190.044976 133.2
[M]+ 169.06976142 124.8
[M]- 169.07085858 124.8
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