CID 11380721

4-(4-fluorophenoxy)benzene-1-carboximidamide hydrochloride

Structural Information

Molecular Formula
C13H11FN2O
SMILES
C1=CC(=CC=C1C(=N)N)OC2=CC=C(C=C2)F
InChI
InChI=1S/C13H11FN2O/c14-10-3-7-12(8-4-10)17-11-5-1-9(2-6-11)13(15)16/h1-8H,(H3,15,16)
InChIKey
WJLOYXHQDZYPOS-UHFFFAOYSA-N
Compound name
4-(4-fluorophenoxy)benzenecarboximidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

12
Patents

230.08554 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 231.09282 148.7
[M+Na]+ 253.07476 155.9
[M-H]- 229.07826 153.9
[M+NH4]+ 248.11936 165.6
[M+K]+ 269.04870 151.8
[M+H-H2O]+ 213.08280 140.2
[M+HCOO]- 275.08374 173.2
[M+CH3COO]- 289.09939 195.3
[M+Na-2H]- 251.06021 153.7
[M]+ 230.08499 144.8
[M]- 230.08609 144.8
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