CID 45788476

2-bromo-5-cyclopropylpyridine

Structural Information

Molecular Formula
C8H8BrN
SMILES
C1CC1C2=CN=C(C=C2)Br
InChI
InChI=1S/C8H8BrN/c9-8-4-3-7(5-10-8)6-1-2-6/h3-6H,1-2H2
InChIKey
WCHBRVOAPMMHIR-UHFFFAOYSA-N
Compound name
2-bromo-5-cyclopropylpyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

146
Patents

196.98401 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 197.99129 126.6
[M+Na]+ 219.97323 133.0
[M+NH4]+ 215.01783 133.3
[M+K]+ 235.94717 133.4
[M-H]- 195.97673 134.6
[M+Na-2H]- 217.95868 135.2
[M]+ 196.98346 129.7
[M]- 196.98456 129.7
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