CID 3683443

1-phenyl-3-[4-(propan-2-yl)phenyl]-1h-pyrazol-5-amine

Structural Information

Molecular Formula
C18H19N3
SMILES
CC(C)C1=CC=C(C=C1)C2=NN(C(=C2)N)C3=CC=CC=C3
InChI
InChI=1S/C18H19N3/c1-13(2)14-8-10-15(11-9-14)17-12-18(19)21(20-17)16-6-4-3-5-7-16/h3-13H,19H2,1-2H3
InChIKey
AYUSIJBBUDUBSY-UHFFFAOYSA-N
Compound name
2-phenyl-5-(4-propan-2-ylphenyl)pyrazol-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

277.1579 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 278.16518 167.3
[M+Na]+ 300.14712 182.1
[M+NH4]+ 295.19172 175.7
[M+K]+ 316.12106 175.9
[M-H]- 276.15062 173.6
[M+Na-2H]- 298.13257 177.5
[M]+ 277.15735 171.3
[M]- 277.15845 171.3
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

No patent data available for this compound.