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

0
Patents

356.31915 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 357.32643 174.7
[M+Na]+ 379.30837 185.1
[M-H]- 355.31187 176.9
[M+NH4]+ 374.35297 187.3
[M+K]+ 395.28231 174.3
[M+H-H2O]+ 339.31641 160.7
[M+HCOO]- 401.31735 176.7
[M+CH3COO]- 415.33300 231.3
[M+Na-2H]- 377.29382 173.6
[M]+ 356.31860 164.9
[M]- 356.31970 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