CID 22317556

5-bromo-2-cyclopropyl-4-methylpyridine

Structural Information

Molecular Formula
C9H10BrN
SMILES
CC1=CC(=NC=C1Br)C2CC2
InChI
InChI=1S/C9H10BrN/c1-6-4-9(7-2-3-7)11-5-8(6)10/h4-5,7H,2-3H2,1H3
InChIKey
VBRYULANOSLPSP-UHFFFAOYSA-N
Compound name
5-bromo-2-cyclopropyl-4-methylpyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

28
Patents

210.99966 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 212.00694 129.8
[M+Na]+ 233.98888 136.4
[M+NH4]+ 229.03348 136.4
[M+K]+ 249.96282 136.8
[M-H]- 209.99238 137.9
[M+Na-2H]- 231.97433 138.0
[M]+ 210.99911 133.0
[M]- 211.00021 133.0
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

patents stripe