CID 21830191

N-methylcyclobutanamine

Structural Information

Molecular Formula

C₅H₁₁N

SMILES

CNC1CCC1

InChI

InChI=1S/C5H11N/c1-6-5-3-2-4-5/h5-6H,2-4H2,1H3

InChIKey

JSIGUUUNVYUWQT-UHFFFAOYSA-N

Compound name

N-methylcyclobutanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1433
Patents: 85.08915 Da
Monoisotopic Mass: 0.7
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]+	86.096426	115.8
[M+Na]+	108.07837	121.9
[M+NH4]+	103.12297	121.5
[M+K]+	124.05231	118.0
[M-H]-	84.081874	115.6
[M+Na-2H]-	106.06382	119.6
[M]+	85.088601	115.3
[M]-	85.089699	115.3

Literature stripe

literature stripe

Patent stripe

patents stripe