CID 21542

Tetraisoamylammonium iodide

Structural Information

Molecular Formula

C₂₀H₄₄N

SMILES

CC(C)CC[N+](CCC(C)C)(CCC(C)C)CCC(C)C

InChI

InChI=1S/C20H44N/c1-17(2)9-13-21(14-10-18(3)4,15-11-19(5)6)16-12-20(7)8/h17-20H,9-16H2,1-8H3/q+1

InChIKey

VPYHKSUKMGPRIN-UHFFFAOYSA-N

Compound name

tetrakis(3-methylbutyl)azanium

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 284
Patents: 298.34738 Da
Monoisotopic Mass: 7.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	299.35466	182.5
[M+Na]+	321.33660	191.2
[M+NH4]+	316.38120	190.2
[M+K]+	337.31054	185.8
[M-H]-	297.34010	183.9
[M+Na-2H]-	319.32205	184.1
[M]+	298.34683	184.5
[M]-	298.34793	184.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe