CID 1132863

1121-46-6

Structural Information

Molecular Formula

SMILES

C1=COC(=C1)CCN

InChI

InChI=1S/C6H9NO/c7-4-3-6-2-1-5-8-6/h1-2,5H,3-4,7H2

InChIKey

ZQSLNSHMUQXSQJ-UHFFFAOYSA-N

Compound name

2-(furan-2-yl)ethanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 2
References: 470
Patents: 111.06841 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]+	112.07569	120.3
[M+Na]+	134.05763	131.2
[M+NH4]+	129.10223	129.4
[M+K]+	150.03157	127.5
[M-H]-	110.06113	123.7
[M+Na-2H]-	132.04308	126.3
[M]+	111.06786	122.6
[M]-	111.06896	122.6

Literature stripe

literature stripe

Patent stripe

patents stripe