CID 22031806

N-cyclopropyl-4-fluoroaniline

Structural Information

Molecular Formula
C9H10FN
SMILES
C1CC1NC2=CC=C(C=C2)F
InChI
InChI=1S/C9H10FN/c10-7-1-3-8(4-2-7)11-9-5-6-9/h1-4,9,11H,5-6H2
InChIKey
JFDXGFOMBAHKCU-UHFFFAOYSA-N
Compound name
N-cyclopropyl-4-fluoroaniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

55
Patents

151.07973 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 152.08701 124.4
[M+Na]+ 174.06895 133.9
[M-H]- 150.07245 131.1
[M+NH4]+ 169.11355 140.7
[M+K]+ 190.04289 130.8
[M+H-H2O]+ 134.07699 117.2
[M+HCOO]- 196.07793 149.7
[M+CH3COO]- 210.09358 181.9
[M+Na-2H]- 172.05440 132.6
[M]+ 151.07918 124.1
[M]- 151.08028 124.1
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