CID 58914620

[(4-methoxyoxan-4-yl)methyl](methyl)amine

Structural Information

Molecular Formula

C₈H₁₇NO₂

SMILES

CNCC1(CCOCC1)OC

InChI

InChI=1S/C8H17NO2/c1-9-7-8(10-2)3-5-11-6-4-8/h9H,3-7H2,1-2H3

InChIKey

QWOAQMJJWPXZCZ-UHFFFAOYSA-N

Compound name

1-(4-methoxyoxan-4-yl)-N-methylmethanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 2
Patents: 159.12593 Da
Monoisotopic Mass: -0.1
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]+	160.13321	134.7
[M+Na]+	182.11515	139.4
[M-H]-	158.11865	138.2
[M+NH4]+	177.15975	155.7
[M+K]+	198.08909	140.6
[M+H-H2O]+	142.12319	129.4
[M+HCOO]-	204.12413	155.7
[M+CH3COO]-	218.13978	177.7
[M+Na-2H]-	180.10060	142.8
[M]+	159.12538	132.9
[M]-	159.12648	132.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe