CID 12330558

4-(3-chlorophenyl)-3-methyl-1h-pyrazol-5-amine

Structural Information

Molecular Formula
C10H10ClN3
SMILES
CC1=C(C(=NN1)N)C2=CC(=CC=C2)Cl
InChI
InChI=1S/C10H10ClN3/c1-6-9(10(12)14-13-6)7-3-2-4-8(11)5-7/h2-5H,1H3,(H3,12,13,14)
InChIKey
HOORSUWNFBFXET-UHFFFAOYSA-N
Compound name
4-(3-chlorophenyl)-5-methyl-1H-pyrazol-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

207.05632 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 208.06360 143.0
[M+Na]+ 230.04554 157.1
[M+NH4]+ 225.09014 151.6
[M+K]+ 246.01948 151.8
[M-H]- 206.04904 146.3
[M+Na-2H]- 228.03099 150.9
[M]+ 207.05577 146.1
[M]- 207.05687 146.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.