CID 60337

109495-32-1

Structural Information

Molecular Formula
C14H34N4
SMILES
C[N+](C)(C)CCN1CCN(CC1)CC[N+](C)(C)C
InChI
InChI=1S/C14H34N4/c1-17(2,3)13-11-15-7-9-16(10-8-15)12-14-18(4,5)6/h7-14H2,1-6H3/q+2
InChIKey
LMPUILOKJPBHGU-UHFFFAOYSA-N
Compound name
trimethyl-[2-[4-[2-(trimethylazaniumyl)ethyl]piperazin-1-yl]ethyl]azanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

258.27835 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 259.28563 159.7
[M+Na]+ 281.26757 162.7
[M-H]- 257.27107 162.5
[M+NH4]+ 276.31217 174.8
[M+K]+ 297.24151 151.5
[M+H-H2O]+ 241.27561 157.5
[M+HCOO]- 303.27655 176.5
[M+CH3COO]- 317.29220 197.5
[M+Na-2H]- 279.25302 170.6
[M]+ 258.27780 156.4
[M]- 258.27890 156.4
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.