CID 16770760

N-(5-amino-2-methoxyphenyl)-3-fluorobenzamide

Structural Information

Molecular Formula
C14H13FN2O2
SMILES
COC1=C(C=C(C=C1)N)NC(=O)C2=CC(=CC=C2)F
InChI
InChI=1S/C14H13FN2O2/c1-19-13-6-5-11(16)8-12(13)17-14(18)9-3-2-4-10(15)7-9/h2-8H,16H2,1H3,(H,17,18)
InChIKey
ZQCYCWDMHIIHJM-UHFFFAOYSA-N
Compound name
N-(5-amino-2-methoxyphenyl)-3-fluorobenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

260.0961 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 261.103376 156.9
[M+Na]+ 283.085318 164.6
[M-H]- 259.088824 162.4
[M+NH4]+ 278.129923 172.9
[M+K]+ 299.059258 160.9
[M+H-H2O]+ 243.093360 148.2
[M+HCOO]- 305.094301 181.2
[M+CH3COO]- 319.109951 201.0
[M+Na-2H]- 281.070766 160.6
[M]+ 260.09555142 155.1
[M]- 260.09664858 155.1
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

No patent data available for this compound.