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]+ 255.279476 169.5
[M+Na]+ 277.261418 171.0
[M-H]- 253.264924 168.5
[M+NH4]+ 272.306023 183.8
[M+K]+ 293.235358 169.7
[M+H-H2O]+ 237.269460 161.5
[M+HCOO]- 299.270401 180.8
[M+CH3COO]- 313.286051 203.5
[M+Na-2H]- 275.246866 165.6
[M]+ 254.27165142 166.7
[M]- 254.27274858 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.