CID 16227430

2-bromo-n-cyclopropyl-2-(4-fluorophenyl)acetamide

Structural Information

Molecular Formula
C11H11BrFNO
SMILES
C1CC1NC(=O)C(C2=CC=C(C=C2)F)Br
InChI
InChI=1S/C11H11BrFNO/c12-10(11(15)14-9-5-6-9)7-1-3-8(13)4-2-7/h1-4,9-10H,5-6H2,(H,14,15)
InChIKey
NNVQPUIQEPLXIJ-UHFFFAOYSA-N
Compound name
2-bromo-N-cyclopropyl-2-(4-fluorophenyl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

271.0008 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 272.008076 149.6
[M+Na]+ 293.990018 160.9
[M-H]- 269.993524 158.0
[M+NH4]+ 289.034623 164.6
[M+K]+ 309.963958 148.9
[M+H-H2O]+ 253.998060 147.5
[M+HCOO]- 315.999001 170.0
[M+CH3COO]- 330.014651 198.9
[M+Na-2H]- 291.975466 154.8
[M]+ 271.00025142 167.0
[M]- 271.00134858 167.0
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.