CID 17401

2576-43-4

Structural Information

Molecular Formula

C₁₀H₂₆N₂O

SMILES

C[N+](C)(C)CCOCC[N+](C)(C)C

InChI

InChI=1S/C10H26N2O/c1-11(2,3)7-9-13-10-8-12(4,5)6/h7-10H2,1-6H3/q+2

InChIKey

KPHDYWYZFFBBNH-UHFFFAOYSA-N

Compound name

trimethyl-[2-[2-(trimethylazaniumyl)ethoxy]ethyl]azanium

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 54
Patents: 190.20451 Da
Monoisotopic Mass: 0.2
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]+	191.21179	142.7
[M+Na]+	213.19373	155.5
[M+NH4]+	208.23833	152.9
[M+K]+	229.16767	151.4
[M-H]-	189.19723	146.9
[M+Na-2H]-	211.17918	149.3
[M]+	190.20396	146.5
[M]-	190.20506	146.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe