CID 89416

2-butanamine, n-ethyl-

Structural Information

Molecular Formula

C₆H₁₅N

SMILES

CCC(C)NCC

InChI

InChI=1S/C6H15N/c1-4-6(3)7-5-2/h6-7H,4-5H2,1-3H3

InChIKey

KFYKZKISJBGVMR-UHFFFAOYSA-N

Compound name

N-ethylbutan-2-amine

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 2219
Patents: 101.12045 Da
Monoisotopic Mass: 1.4
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]+	102.12773	123.5
[M+Na]+	124.10967	129.6
[M-H]-	100.11317	123.9
[M+NH4]+	119.15427	146.7
[M+K]+	140.08361	129.9
[M+H-H2O]+	84.117710	119.0
[M+HCOO]-	146.11865	147.3
[M+CH3COO]-	160.13430	172.9
[M+Na-2H]-	122.09512	129.6
[M]+	101.11990	123.3
[M]-	101.12100	123.3

Literature stripe

literature stripe

Patent stripe

patents stripe