CID 115406

63939-07-1

Structural Information

Molecular Formula

C₁₀H₂₄NO

SMILES

CCCCOC(C)C[N+](C)(C)C

InChI

InChI=1S/C10H24NO/c1-6-7-8-12-10(2)9-11(3,4)5/h10H,6-9H2,1-5H3/q+1

InChIKey

QMSNHLKIEAGWCR-UHFFFAOYSA-N

Compound name

2-butoxypropyl(trimethyl)azanium

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 174.18579 Da
Monoisotopic Mass: 1.8
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]+	175.19307	140.6
[M+Na]+	197.17501	151.9
[M+NH4]+	192.21961	149.8
[M+K]+	213.14895	147.0
[M-H]-	173.17851	142.6
[M+Na-2H]-	195.16046	145.5
[M]+	174.18524	143.1
[M]-	174.18634	143.1

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.