CID 23547760

89381-07-7

Structural Information

Molecular Formula

C₅H₁₁N

SMILES

CC1CC(C1)N

InChI

InChI=1S/C5H11N/c1-4-2-5(6)3-4/h4-5H,2-3,6H2,1H3

InChIKey

GNHDRVDLNQEOPA-UHFFFAOYSA-N

Compound name

3-methylcyclobutan-1-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 201
Patents: 85.08915 Da
Monoisotopic Mass: 0.6
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	115.4
[M+Na]+	108.07837	121.5
[M-H]-	84.081874	118.8
[M+NH4]+	103.12297	132.5
[M+K]+	124.05231	124.1
[M+H-H2O]+	68.086410	105.8
[M+HCOO]-	130.08735	138.1
[M+CH3COO]-	144.10300	171.0
[M+Na-2H]-	106.06382	121.3
[M]+	85.088601	120.7
[M]-	85.089699	120.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe