CID 3352034

3-(4-fluorophenyl)-1-phenyl-1h-pyrazol-5-amine

Structural Information

Molecular Formula
C15H12FN3
SMILES
C1=CC=C(C=C1)N2C(=CC(=N2)C3=CC=C(C=C3)F)N
InChI
InChI=1S/C15H12FN3/c16-12-8-6-11(7-9-12)14-10-15(17)19(18-14)13-4-2-1-3-5-13/h1-10H,17H2
InChIKey
QCEVUBQDNVSIHB-UHFFFAOYSA-N
Compound name
5-(4-fluorophenyl)-2-phenylpyrazol-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

253.10153 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 254.10881 157.3
[M+Na]+ 276.09075 172.0
[M+NH4]+ 271.13535 165.5
[M+K]+ 292.06469 165.7
[M-H]- 252.09425 162.2
[M+Na-2H]- 274.07620 167.7
[M]+ 253.10098 160.8
[M]- 253.10208 160.8
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

patents stripe