CID 131376700

3-bromo-1h-pyrazolo[4,3-c]pyridine-7-carbonitrile

Structural Information

Molecular Formula
C7H3BrN4
SMILES
C1=C(C2=NNC(=C2C=N1)Br)C#N
InChI
InChI=1S/C7H3BrN4/c8-7-5-3-10-2-4(1-9)6(5)11-12-7/h2-3H,(H,11,12)
InChIKey
IKEODOUXLUVXOV-UHFFFAOYSA-N
Compound name
3-bromo-2H-pyrazolo[4,3-c]pyridine-7-carbonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

221.95412 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 222.96140 144.4
[M+Na]+ 244.94334 149.2
[M+NH4]+ 239.98794 146.1
[M+K]+ 260.91728 147.0
[M-H]- 220.94684 137.5
[M+Na-2H]- 242.92879 145.5
[M]+ 221.95357 141.4
[M]- 221.95467 141.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

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No literature data available for this compound.

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No patent data available for this compound.