CID 72212717

3-bromo-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine

Structural Information

Molecular Formula
C7H9BrN2
SMILES
C1CCN2C(=C(C=N2)Br)C1
InChI
InChI=1S/C7H9BrN2/c8-6-5-9-10-4-2-1-3-7(6)10/h5H,1-4H2
InChIKey
RHPLGVPJDFRGHY-UHFFFAOYSA-N
Compound name
3-bromo-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

17
Patents

199.9949 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 201.00218 139.2
[M+Na]+ 222.98412 141.9
[M+NH4]+ 218.02872 144.8
[M+K]+ 238.95806 142.8
[M-H]- 198.98762 139.1
[M+Na-2H]- 220.96957 141.4
[M]+ 199.99435 138.2
[M]- 199.99545 138.2
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