CID 22179853

1-(4,4-dimethylcyclohexyl)piperazine

Structural Information

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

2D Structure

compound 2d structure
1
Annotation Hits

0
References

13
Patents

196.19395 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 197.201226 151.1
[M+Na]+ 219.183168 153.8
[M-H]- 195.186674 151.9
[M+NH4]+ 214.227773 168.5
[M+K]+ 235.157108 150.9
[M+H-H2O]+ 179.191210 143.0
[M+HCOO]- 241.192151 163.3
[M+CH3COO]- 255.207801 181.6
[M+Na-2H]- 217.168616 153.7
[M]+ 196.19340142 140.6
[M]- 196.19449858 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