CID 5005279

N-tert-butyl-2-fluorobenzamide

Structural Information

Molecular Formula
C11H14FNO
SMILES
CC(C)(C)NC(=O)C1=CC=CC=C1F
InChI
InChI=1S/C11H14FNO/c1-11(2,3)13-10(14)8-6-4-5-7-9(8)12/h4-7H,1-3H3,(H,13,14)
InChIKey
BQTOGGBBTUSQOE-UHFFFAOYSA-N
Compound name
N-tert-butyl-2-fluorobenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

20
Patents

195.10594 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 196.11322 144.0
[M+Na]+ 218.09516 154.7
[M+NH4]+ 213.13976 151.4
[M+K]+ 234.06910 149.2
[M-H]- 194.09866 144.5
[M+Na-2H]- 216.08061 149.9
[M]+ 195.10539 145.5
[M]- 195.10649 145.5
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