CID 59555815

4-bromo-6,7-dihydro-5h-cyclopenta[b]pyridine

Structural Information

Molecular Formula
C8H8BrN
SMILES
C1CC2=C(C=CN=C2C1)Br
InChI
InChI=1S/C8H8BrN/c9-7-4-5-10-8-3-1-2-6(7)8/h4-5H,1-3H2
InChIKey
CPVMPCSZGBHELB-UHFFFAOYSA-N
Compound name
4-bromo-6,7-dihydro-5H-cyclopenta[b]pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

30
Patents

196.98401 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 197.99129 136.7
[M+Na]+ 219.97323 140.4
[M+NH4]+ 215.01783 143.1
[M+K]+ 235.94717 140.7
[M-H]- 195.97673 137.7
[M+Na-2H]- 217.95868 140.1
[M]+ 196.98346 136.3
[M]- 196.98456 136.3
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