CID 83680672

3-bromo-5-methylpyrazolo[1,5-a]pyridine

Structural Information

Molecular Formula
C8H7BrN2
SMILES
CC1=CC2=C(C=NN2C=C1)Br
InChI
InChI=1S/C8H7BrN2/c1-6-2-3-11-8(4-6)7(9)5-10-11/h2-5H,1H3
InChIKey
UEUSPICQNPUFDR-UHFFFAOYSA-N
Compound name
3-bromo-5-methylpyrazolo[1,5-a]pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

209.97926 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 210.98654 134.0
[M+Na]+ 232.96848 149.4
[M-H]- 208.97198 139.8
[M+NH4]+ 228.01308 157.4
[M+K]+ 248.94242 138.4
[M+H-H2O]+ 192.97652 134.2
[M+HCOO]- 254.97746 156.2
[M+CH3COO]- 268.99311 150.8
[M+Na-2H]- 230.95393 143.9
[M]+ 209.97871 155.0
[M]- 209.97981 155.0
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