CID 76938

2-(1-cyclohexenyl)ethylamine

Structural Information

Molecular Formula

C₈H₁₅N

SMILES

C1CCC(=CC1)CCN

InChI

InChI=1S/C8H15N/c9-7-6-8-4-2-1-3-5-8/h4H,1-3,5-7,9H2

InChIKey

IUDMXOOVKMKODN-UHFFFAOYSA-N

Compound name

2-(cyclohexen-1-yl)ethanamine

Related CIDs

2D Structure

compound 2d structure

3
Annotation Hits: 4
References: 1121
Patents: 125.12045 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]+	126.12773	127.3
[M+Na]+	148.10967	138.2
[M+NH4]+	143.15427	137.0
[M+K]+	164.08361	131.3
[M-H]-	124.11317	130.6
[M+Na-2H]-	146.09512	133.9
[M]+	125.11990	129.6
[M]-	125.12100	129.6

Literature stripe

literature stripe

Patent stripe

patents stripe