CID 29009701

2839156-19-1

Structural Information

Molecular Formula
C10H18N4
SMILES
CN1C=C(C=N1)CN2CCC(CC2)N
InChI
InChI=1S/C10H18N4/c1-13-7-9(6-12-13)8-14-4-2-10(11)3-5-14/h6-7,10H,2-5,8,11H2,1H3
InChIKey
KVXQMXSOEWSFCP-UHFFFAOYSA-N
Compound name
1-[(1-methylpyrazol-4-yl)methyl]piperidin-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

194.15315 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 195.160426 145.8
[M+Na]+ 217.142368 152.0
[M-H]- 193.145874 147.5
[M+NH4]+ 212.186973 162.4
[M+K]+ 233.116308 149.1
[M+H-H2O]+ 177.150410 136.6
[M+HCOO]- 239.151351 164.4
[M+CH3COO]- 253.167001 185.6
[M+Na-2H]- 215.127816 148.2
[M]+ 194.15260142 140.6
[M]- 194.15369858 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