CID 79020483

5-bromo-3-methyl-2-(1h-pyrazol-1-yl)pyridine hydrochloride

Structural Information

Molecular Formula
C9H8BrN3
SMILES
CC1=CC(=CN=C1N2C=CC=N2)Br
InChI
InChI=1S/C9H8BrN3/c1-7-5-8(10)6-11-9(7)13-4-2-3-12-13/h2-6H,1H3
InChIKey
IRXQTISFTVGDCJ-UHFFFAOYSA-N
Compound name
5-bromo-3-methyl-2-pyrazol-1-ylpyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

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References

0
Patents

236.99016 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 237.99744 147.1
[M+Na]+ 259.97938 152.1
[M+NH4]+ 255.02398 151.8
[M+K]+ 275.95332 152.7
[M-H]- 235.98288 148.1
[M+Na-2H]- 257.96483 152.3
[M]+ 236.98961 147.0
[M]- 236.99071 147.0
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.