CID 10820849

176445-80-0

Structural Information

Molecular Formula

C₈H₁₈N₂O

SMILES

CN(C)C1(CCOCC1)CN

InChI

InChI=1S/C8H18N2O/c1-10(2)8(7-9)3-5-11-6-4-8/h3-7,9H2,1-2H3

InChIKey

KCLFWPREWYWLTP-UHFFFAOYSA-N

Compound name

4-(aminomethyl)-N,N-dimethyloxan-4-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 132
Patents: 158.1419 Da
Monoisotopic Mass: -0.5
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]+	159.14918	136.6
[M+Na]+	181.13112	145.4
[M+NH4]+	176.17572	146.6
[M+K]+	197.10506	138.8
[M-H]-	157.13462	140.9
[M+Na-2H]-	179.11657	142.7
[M]+	158.14135	139.0
[M]-	158.14245	139.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe