CID 64467057

1-(3,3-dimethylcyclohexyl)piperazine

Structural Information

Molecular Formula
C12H24N2
SMILES
CC1(CCCC(C1)N2CCNCC2)C
InChI
InChI=1S/C12H24N2/c1-12(2)5-3-4-11(10-12)14-8-6-13-7-9-14/h11,13H,3-10H2,1-2H3
InChIKey
ZWPMAVFKPWAIDX-UHFFFAOYSA-N
Compound name
1-(3,3-dimethylcyclohexyl)piperazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

196.19395 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 197.20123 151.1
[M+Na]+ 219.18317 153.8
[M-H]- 195.18667 151.9
[M+NH4]+ 214.22777 168.5
[M+K]+ 235.15711 150.9
[M+H-H2O]+ 179.19121 143.0
[M+HCOO]- 241.19215 163.3
[M+CH3COO]- 255.20780 181.6
[M+Na-2H]- 217.16862 153.7
[M]+ 196.19340 140.6
[M]- 196.19450 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

No patent data available for this compound.