CID 54423964

2229435-12-3

Structural Information

Molecular Formula

C₇H₁₃N

SMILES

C=CCC1(CCC1)N

InChI

InChI=1S/C7H13N/c1-2-4-7(8)5-3-6-7/h2H,1,3-6,8H2

InChIKey

DTYCOBRGPYFLAL-UHFFFAOYSA-N

Compound name

1-prop-2-enylcyclobutan-1-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 15
Patents: 111.1048 Da
Monoisotopic Mass: 1.1
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	125.3
[M+Na]+	134.09402	130.9
[M+NH4]+	129.13862	131.6
[M+K]+	150.06796	125.0
[M-H]-	110.09752	124.6
[M+Na-2H]-	132.07947	129.5
[M]+	111.10425	124.7
[M]-	111.10535	124.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe