CID 55295072

1-cyclobutylprop-2-en-1-amine hydrochloride

Structural Information

Molecular Formula

C₇H₁₃N

SMILES

C=CC(C1CCC1)N

InChI

InChI=1S/C7H13N/c1-2-7(8)6-4-3-5-6/h2,6-7H,1,3-5,8H2

InChIKey

GEOLBRQXIANOAG-UHFFFAOYSA-N

Compound name

1-cyclobutylprop-2-en-1-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 62
Patents: 111.1048 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]+	112.11208	126.3
[M+Na]+	134.09402	131.3
[M+NH4]+	129.13862	131.1
[M+K]+	150.06796	127.8
[M-H]-	110.09752	125.3
[M+Na-2H]-	132.07947	128.5
[M]+	111.10425	125.3
[M]-	111.10535	125.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe