CID 3039332

1,6-bis(2,2,6,6-tetramethylpiperidino)-2,4-hexadiyne

Structural Information

Molecular Formula
C24H40N2
SMILES
CC1(CCCC(N1CC#CC#CCN2C(CCCC2(C)C)(C)C)(C)C)C
InChI
InChI=1S/C24H40N2/c1-21(2)15-13-16-22(3,4)25(21)19-11-9-10-12-20-26-23(5,6)17-14-18-24(26,7)8/h13-20H2,1-8H3
InChIKey
NGORXNIHHOTVJG-UHFFFAOYSA-N
Compound name
2,2,6,6-tetramethyl-1-[6-(2,2,6,6-tetramethylpiperidin-1-yl)hexa-2,4-diynyl]piperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

356.31915 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 357.326426 174.7
[M+Na]+ 379.308368 185.1
[M-H]- 355.311874 176.9
[M+NH4]+ 374.352973 187.3
[M+K]+ 395.282308 174.3
[M+H-H2O]+ 339.316410 160.7
[M+HCOO]- 401.317351 176.7
[M+CH3COO]- 415.333001 231.3
[M+Na-2H]- 377.293816 173.6
[M]+ 356.31860142 164.9
[M]- 356.31969858 164.9
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