CID 24729714

(1-aminocyclopent-3-en-1-yl)methanol

Structural Information

Molecular Formula

SMILES

C1C=CCC1(CO)N

InChI

InChI=1S/C6H11NO/c7-6(5-8)3-1-2-4-6/h1-2,8H,3-5,7H2

InChIKey

NWIIFKYGKOLKML-UHFFFAOYSA-N

Compound name

(1-aminocyclopent-3-en-1-yl)methanol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 113.08406 Da
Monoisotopic Mass: -0.4
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]+	114.09134	122.1
[M+Na]+	136.07328	131.3
[M+NH4]+	131.11788	132.3
[M+K]+	152.04722	126.1
[M-H]-	112.07678	123.5
[M+Na-2H]-	134.05873	128.6
[M]+	113.08351	123.7
[M]-	113.08461	123.7

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.