CID 6485353

1-[(trimethyl-1h-pyrazol-4-yl)methyl]piperazine

Structural Information

Molecular Formula
C11H20N4
SMILES
CC1=C(C(=NN1C)C)CN2CCNCC2
InChI
InChI=1S/C11H20N4/c1-9-11(10(2)14(3)13-9)8-15-6-4-12-5-7-15/h12H,4-8H2,1-3H3
InChIKey
SNHLSCHBRJBXFN-UHFFFAOYSA-N
Compound name
1-[(1,3,5-trimethylpyrazol-4-yl)methyl]piperazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

208.1688 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 209.17608 152.4
[M+Na]+ 231.15802 159.7
[M-H]- 207.16152 152.1
[M+NH4]+ 226.20262 167.3
[M+K]+ 247.13196 155.8
[M+H-H2O]+ 191.16606 143.1
[M+HCOO]- 253.16700 167.3
[M+CH3COO]- 267.18265 185.9
[M+Na-2H]- 229.14347 153.3
[M]+ 208.16825 148.3
[M]- 208.16935 148.3
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

No patent data available for this compound.