CID 3118928

4-bromo-1-naphthoyl fluoride

Structural Information

Molecular Formula
C11H6BrFO
SMILES
C1=CC=C2C(=C1)C(=CC=C2Br)C(=O)F
InChI
InChI=1S/C11H6BrFO/c12-10-6-5-9(11(13)14)7-3-1-2-4-8(7)10/h1-6H
InChIKey
SUYJUKIEPSLNMW-UHFFFAOYSA-N
Compound name
4-bromonaphthalene-1-carbonyl fluoride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

251.9586 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 252.96588 145.1
[M+Na]+ 274.94782 157.7
[M-H]- 250.95132 151.4
[M+NH4]+ 269.99242 167.0
[M+K]+ 290.92176 146.2
[M+H-H2O]+ 234.95586 144.8
[M+HCOO]- 296.95680 164.8
[M+CH3COO]- 310.97245 191.7
[M+Na-2H]- 272.93327 152.9
[M]+ 251.95805 162.8
[M]- 251.95915 162.8
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

No patent data available for this compound.