CID 2380354

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

Structural Information

Molecular Formula
C10H10FN3
SMILES
CC1=NN(C(=C1)N)C2=CC=C(C=C2)F
InChI
InChI=1S/C10H10FN3/c1-7-6-10(12)14(13-7)9-4-2-8(11)3-5-9/h2-6H,12H2,1H3
InChIKey
TZLARBJWGJNNIP-UHFFFAOYSA-N
Compound name
2-(4-fluorophenyl)-5-methylpyrazol-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

31
Patents

191.08588 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 192.09316 138.4
[M+Na]+ 214.07510 148.8
[M-H]- 190.07860 141.8
[M+NH4]+ 209.11970 157.1
[M+K]+ 230.04904 144.8
[M+H-H2O]+ 174.08314 129.8
[M+HCOO]- 236.08408 161.7
[M+CH3COO]- 250.09973 151.9
[M+Na-2H]- 212.06055 142.8
[M]+ 191.08533 136.4
[M]- 191.08643 136.4
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