CID 67113476

1296309-30-2

Structural Information

Molecular Formula
C10H18N4
SMILES
CN1CCCC(C1)CN2C=C(C=N2)N
InChI
InChI=1S/C10H18N4/c1-13-4-2-3-9(6-13)7-14-8-10(11)5-12-14/h5,8-9H,2-4,6-7,11H2,1H3
InChIKey
ZHIVBAWKAMMQIV-UHFFFAOYSA-N
Compound name
1-[(1-methylpiperidin-3-yl)methyl]pyrazol-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

8
Patents

194.15315 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 195.16043 145.8
[M+Na]+ 217.14237 152.0
[M-H]- 193.14587 147.5
[M+NH4]+ 212.18697 162.4
[M+K]+ 233.11631 149.1
[M+H-H2O]+ 177.15041 136.6
[M+HCOO]- 239.15135 164.4
[M+CH3COO]- 253.16700 185.6
[M+Na-2H]- 215.12782 148.2
[M]+ 194.15260 140.6
[M]- 194.15370 140.6
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