CID 532009

3-fluoro-n-(4-methoxyphenyl)benzamide

Structural Information

Molecular Formula
C14H12FNO2
SMILES
COC1=CC=C(C=C1)NC(=O)C2=CC(=CC=C2)F
InChI
InChI=1S/C14H12FNO2/c1-18-13-7-5-12(6-8-13)16-14(17)10-3-2-4-11(15)9-10/h2-9H,1H3,(H,16,17)
InChIKey
QQHQVSLNPRAISI-UHFFFAOYSA-N
Compound name
3-fluoro-N-(4-methoxyphenyl)benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

0
Patents

245.0852 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 246.09248 152.4
[M+Na]+ 268.07442 160.0
[M-H]- 244.07792 158.1
[M+NH4]+ 263.11902 169.3
[M+K]+ 284.04836 156.6
[M+H-H2O]+ 228.08246 143.9
[M+HCOO]- 290.08340 176.4
[M+CH3COO]- 304.09905 195.3
[M+Na-2H]- 266.05987 157.5
[M]+ 245.08465 151.9
[M]- 245.08575 151.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.