CID 61755910

3-methoxy-n-methyloxan-4-amine

Structural Information

Molecular Formula

C₇H₁₅NO₂

SMILES

CNC1CCOCC1OC

InChI

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

InChIKey

ZIBNFUACDRISHN-UHFFFAOYSA-N

Compound name

3-methoxy-N-methyloxan-4-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 14
Patents: 145.11028 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]+	146.11756	130.7
[M+Na]+	168.09950	135.9
[M-H]-	144.10300	134.4
[M+NH4]+	163.14410	150.5
[M+K]+	184.07344	137.0
[M+H-H2O]+	128.10754	125.0
[M+HCOO]-	190.10848	152.1
[M+CH3COO]-	204.12413	176.3
[M+Na-2H]-	166.08495	137.5
[M]+	145.10973	128.7
[M]-	145.11083	128.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe