CID 24833305

(5-guanidinopentyl)trimethylammonium iodide hydriodide

Structural Information

Molecular Formula
C9H23N4
SMILES
C[N+](C)(C)CCCCCN=C(N)N
InChI
InChI=1S/C9H23N4/c1-13(2,3)8-6-4-5-7-12-9(10)11/h4-8H2,1-3H3,(H4,10,11,12)/q+1
InChIKey
QWUKIXNFIXFUOU-UHFFFAOYSA-N
Compound name
5-(diaminomethylideneamino)pentyl-trimethylazanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

187.19228 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 188.19956 140.9
[M+Na]+ 210.18150 144.8
[M-H]- 186.18500 142.8
[M+NH4]+ 205.22610 160.4
[M+K]+ 226.15544 139.5
[M+H-H2O]+ 170.18954 137.5
[M+HCOO]- 232.19048 166.7
[M+CH3COO]- 246.20613 192.3
[M+Na-2H]- 208.16695 148.3
[M]+ 187.19173 138.2
[M]- 187.19283 138.2
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.