CID 3064079

101975-91-1

Structural Information

Molecular Formula
C16H34N2
SMILES
CC(C)CC(C)N1CCN(CC1)C(C)CC(C)C
InChI
InChI=1S/C16H34N2/c1-13(2)11-15(5)17-7-9-18(10-8-17)16(6)12-14(3)4/h13-16H,7-12H2,1-6H3
InChIKey
JFIKBLWUBSNXGM-UHFFFAOYSA-N
Compound name
1,4-bis(4-methylpentan-2-yl)piperazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

254.2722 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 255.27948 169.5
[M+Na]+ 277.26142 171.0
[M-H]- 253.26492 168.5
[M+NH4]+ 272.30602 183.8
[M+K]+ 293.23536 169.7
[M+H-H2O]+ 237.26946 161.5
[M+HCOO]- 299.27040 180.8
[M+CH3COO]- 313.28605 203.5
[M+Na-2H]- 275.24687 165.6
[M]+ 254.27165 166.7
[M]- 254.27275 166.7
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.