CID 1084924

3524-30-9

Structural Information

Molecular Formula
C9H16N4
SMILES
CN1CCC(CC1)N2C(=CC=N2)N
InChI
InChI=1S/C9H16N4/c1-12-6-3-8(4-7-12)13-9(10)2-5-11-13/h2,5,8H,3-4,6-7,10H2,1H3
InChIKey
QCNNKYQIYTZXJX-UHFFFAOYSA-N
Compound name
2-(1-methylpiperidin-4-yl)pyrazol-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

2
Patents

180.1375 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 181.14478 141.4
[M+Na]+ 203.12672 148.1
[M-H]- 179.13022 143.3
[M+NH4]+ 198.17132 158.5
[M+K]+ 219.10066 145.4
[M+H-H2O]+ 163.13476 132.4
[M+HCOO]- 225.13570 160.3
[M+CH3COO]- 239.15135 153.0
[M+Na-2H]- 201.11217 144.3
[M]+ 180.13695 135.8
[M]- 180.13805 135.8
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