CID 19017814

60637-97-0

Structural Information

Molecular Formula

C₆H₁₃N

SMILES

C1CC(C1)CCN

InChI

InChI=1S/C6H13N/c7-5-4-6-2-1-3-6/h6H,1-5,7H2

InChIKey

MGAPESYORZVKQD-UHFFFAOYSA-N

Compound name

2-cyclobutylethanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 444
Patents: 99.1048 Da
Monoisotopic Mass: 1.3
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]+	100.112076	119.9
[M+Na]+	122.094018	124.6
[M-H]-	98.097524	122.7
[M+NH4]+	117.138623	136.1
[M+K]+	138.067958	127.0
[M+H-H2O]+	82.102060	109.7
[M+HCOO]-	144.103001	142.3
[M+CH3COO]-	158.118651	172.9
[M+Na-2H]-	120.079466	125.9
[M]+	99.10425142	125.1
[M]-	99.10534858	125.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe