CID 9570706

Ammonium, glutarylbis(iminoethylene)bis(trimethyl-, diiodide

Structural Information

Molecular Formula
C15H34N4O2
SMILES
C[N+](C/C=N/C(O)CCCC(O)/N=C/C[N+](C)(C)C)(C)C
InChI
InChI=1S/C15H34N4O2/c1-18(2,3)12-10-16-14(20)8-7-9-15(21)17-11-13-19(4,5)6/h10-11,14-15,20-21H,7-9,12-13H2,1-6H3/q+2/b16-10+,17-11+
InChIKey
FLDHCGMNBISVEU-OTYYAQKOSA-N
Compound name
[(2E)-2-[1,5-dihydroxy-5-[(E)-2-(trimethylazaniumyl)ethylideneamino]pentyl]iminoethyl]-trimethylazanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

302.2682 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 303.27548 167.0
[M+Na]+ 325.25742 168.9
[M-H]- 301.26092 169.4
[M+NH4]+ 320.30202 227.4
[M+K]+ 341.23136 158.5
[M+H-H2O]+ 285.26546 166.1
[M+HCOO]- 347.26640 241.2
[M+CH3COO]- 361.28205 208.2
[M+Na-2H]- 323.24287 176.5
[M]+ 302.26765 167.4
[M]- 302.26875 167.4
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.