CID 79574072

2-methoxy-1-(oxolan-2-yl)ethan-1-amine

Structural Information

Molecular Formula

C₇H₁₅NO₂

SMILES

COCC(C1CCCO1)N

InChI

InChI=1S/C7H15NO2/c1-9-5-6(8)7-3-2-4-10-7/h6-7H,2-5,8H2,1H3

InChIKey

QIVJYUVLXZOQOH-UHFFFAOYSA-N

Compound name

2-methoxy-1-(oxolan-2-yl)ethanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 3
Patents: 145.11028 Da
Monoisotopic Mass: -0.4
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]+	146.11756	132.6
[M+Na]+	168.09950	137.4
[M-H]-	144.10300	135.6
[M+NH4]+	163.14410	153.5
[M+K]+	184.07344	138.5
[M+H-H2O]+	128.10754	127.0
[M+HCOO]-	190.10848	154.4
[M+CH3COO]-	204.12413	175.1
[M+Na-2H]-	166.08495	136.5
[M]+	145.10973	130.5
[M]-	145.11083	130.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe