CID 68793761

2-(chloromethyl)-4h,5h,6h,7h-pyrazolo[1,5-a]pyridine

Structural Information

Molecular Formula
C8H11ClN2
SMILES
C1CCN2C(=CC(=N2)CCl)C1
InChI
InChI=1S/C8H11ClN2/c9-6-7-5-8-3-1-2-4-11(8)10-7/h5H,1-4,6H2
InChIKey
QWNDXWFLUYJIMF-UHFFFAOYSA-N
Compound name
2-(chloromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

170.06108 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 171.06836 135.0
[M+Na]+ 193.05030 143.8
[M-H]- 169.05380 136.0
[M+NH4]+ 188.09490 156.3
[M+K]+ 209.02424 139.9
[M+H-H2O]+ 153.05834 128.2
[M+HCOO]- 215.05928 150.2
[M+CH3COO]- 229.07493 147.9
[M+Na-2H]- 191.03575 140.7
[M]+ 170.06053 134.2
[M]- 170.06163 134.2
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