CID 43888

Ammonium, oxalylbis(iminoethylene)bis(triethyl-, diiodide

Structural Information

Molecular Formula
C18H40N4O2
SMILES
CC[N+](CC)(CC)CCNC(=O)C(=O)NCC[N+](CC)(CC)CC
InChI
InChI=1S/C18H38N4O2/c1-7-21(8-2,9-3)15-13-19-17(23)18(24)20-14-16-22(10-4,11-5)12-6/h7-16H2,1-6H3/p+2
InChIKey
CZHUFHLKBYIUAC-UHFFFAOYSA-P
Compound name
triethyl-[2-[[2-oxo-2-[2-(triethylazaniumyl)ethylamino]acetyl]amino]ethyl]azanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

344.31512 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 345.32240 181.1
[M+Na]+ 367.30434 248.2
[M-H]- 343.30784 240.2
[M+NH4]+ 362.34894 238.9
[M+K]+ 383.27828 170.7
[M+H-H2O]+ 327.31238 179.6
[M+HCOO]- 389.31332 251.7
[M+CH3COO]- 403.32897 216.4
[M+Na-2H]- 365.28979 189.1
[M]+ 344.31457 231.3
[M]- 344.31567 231.3
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.