CID 46087

Hl-8732

Structural Information

Molecular Formula
C15H36N2O
SMILES
CC[N+](C)(C)CCOC(C)C[N+](CC)(CC)CC
InChI
InChI=1S/C15H36N2O/c1-8-16(6,7)12-13-18-15(5)14-17(9-2,10-3)11-4/h15H,8-14H2,1-7H3/q+2
InChIKey
CCYMEPSDYBKUHG-UHFFFAOYSA-N
Compound name
triethyl-[2-[2-[ethyl(dimethyl)azaniumyl]ethoxy]propyl]azanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

260.28278 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 261.29006 162.9
[M+Na]+ 283.27200 166.3
[M-H]- 259.27550 165.5
[M+NH4]+ 278.31660 180.8
[M+K]+ 299.24594 156.1
[M+H-H2O]+ 243.28004 162.9
[M+HCOO]- 305.28098 183.9
[M+CH3COO]- 319.29663 200.6
[M+Na-2H]- 281.25745 172.3
[M]+ 260.28223 166.0
[M]- 260.28333 166.0
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.