CID 81653

N,n-dimethylisobutylamine

Structural Information

Molecular Formula

C₆H₁₅N

SMILES

CC(C)CN(C)C

InChI

InChI=1S/C6H15N/c1-6(2)5-7(3)4/h6H,5H2,1-4H3

InChIKey

GDHRQDYGUDOEIZ-UHFFFAOYSA-N

Compound name

N,N,2-trimethylpropan-1-amine

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 1
References: 2313
Patents: 101.12045 Da
Monoisotopic Mass: 1.0
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]+	102.127726	123.0
[M+Na]+	124.109668	129.4
[M-H]-	100.113174	125.0
[M+NH4]+	119.154273	146.9
[M+K]+	140.083608	131.1
[M+H-H2O]+	84.117710	118.3
[M+HCOO]-	146.118651	147.3
[M+CH3COO]-	160.134301	176.5
[M+Na-2H]-	122.095116	128.4
[M]+	101.11990142	124.1
[M]-	101.12099858	124.1

Literature stripe

literature stripe

Patent stripe

patents stripe