CID 67281938

5-bromo-1,6-dimethylpyridin-2(1h)-one

Structural Information

Molecular Formula
C7H8BrNO
SMILES
CC1=C(C=CC(=O)N1C)Br
InChI
InChI=1S/C7H8BrNO/c1-5-6(8)3-4-7(10)9(5)2/h3-4H,1-2H3
InChIKey
ZTEAINHRFDYRQT-UHFFFAOYSA-N
Compound name
5-bromo-1,6-dimethylpyridin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

36
Patents

200.97893 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 201.98621 131.5
[M+Na]+ 223.96815 136.6
[M+NH4]+ 219.01275 136.6
[M+K]+ 239.94209 136.4
[M-H]- 199.97165 132.0
[M+Na-2H]- 221.95360 135.8
[M]+ 200.97838 131.2
[M]- 200.97948 131.2
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