CID 14818493

N-ethyl-1h-pyrazol-3-amine

Structural Information

Molecular Formula
C5H9N3
SMILES
CCNC1=CC=NN1
InChI
InChI=1S/C5H9N3/c1-2-6-5-3-4-7-8-5/h3-4H,2H2,1H3,(H2,6,7,8)
InChIKey
FVSRJWMYUVOQNY-UHFFFAOYSA-N
Compound name
N-ethyl-1H-pyrazol-5-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

43
Patents

111.07965 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 112.08693 120.7
[M+Na]+ 134.06887 128.4
[M-H]- 110.07237 120.3
[M+NH4]+ 129.11347 141.5
[M+K]+ 150.04281 126.7
[M+H-H2O]+ 94.076910 113.7
[M+HCOO]- 156.07785 144.2
[M+CH3COO]- 170.09350 166.9
[M+Na-2H]- 132.05432 128.5
[M]+ 111.07910 118.2
[M]- 111.08020 118.2
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