CID 21021478

N,1-dimethylcyclobutan-1-amine hydrochloride

Structural Information

Molecular Formula

C₆H₁₃N

SMILES

CC1(CCC1)NC

InChI

InChI=1S/C6H13N/c1-6(7-2)4-3-5-6/h7H,3-5H2,1-2H3

InChIKey

BRRVPUKFALTISS-UHFFFAOYSA-N

Compound name

N,1-dimethylcyclobutan-1-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 95
Patents: 99.1048 Da
Monoisotopic Mass: 0.9
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]+	100.11208	120.8
[M+Na]+	122.09402	126.8
[M+NH4]+	117.13862	127.7
[M+K]+	138.06796	121.1
[M-H]-	98.097524	120.6
[M+Na-2H]-	120.07947	125.9
[M]+	99.104251	120.5
[M]-	99.105349	120.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe