CID 12356179

N-methyl-5-phenyl-1h-pyrazol-3-amine

Structural Information

Molecular Formula
C10H11N3
SMILES
CNC1=NNC(=C1)C2=CC=CC=C2
InChI
InChI=1S/C10H11N3/c1-11-10-7-9(12-13-10)8-5-3-2-4-6-8/h2-7H,1H3,(H2,11,12,13)
InChIKey
RKZLEVRKZGNWES-UHFFFAOYSA-N
Compound name
N-methyl-5-phenyl-1H-pyrazol-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

37
Patents

173.09529 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 174.10257 137.0
[M+Na]+ 196.08451 149.8
[M+NH4]+ 191.12911 145.4
[M+K]+ 212.05845 144.7
[M-H]- 172.08801 140.3
[M+Na-2H]- 194.06996 145.8
[M]+ 173.09474 139.6
[M]- 173.09584 139.6
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

patents stripe