CID 520907

3850-30-4

Structural Information

Molecular Formula

C₆H₁₅N

SMILES

CC(C(C)(C)C)N

InChI

InChI=1S/C6H15N/c1-5(7)6(2,3)4/h5H,7H2,1-4H3

InChIKey

DXSUORGKJZADET-UHFFFAOYSA-N

Compound name

3,3-dimethylbutan-2-amine

Related CIDs

2D Structure

compound 2d structure

3
Annotation Hits: 2
References: 3229
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	130.2
[M-H]-	100.11317	123.7
[M+NH4]+	119.15427	146.6
[M+K]+	140.08361	130.5
[M+H-H2O]+	84.117710	119.7
[M+HCOO]-	146.11865	145.1
[M+CH3COO]-	160.13430	171.7
[M+Na-2H]-	122.09512	129.1
[M]+	101.11990	121.7
[M]-	101.12100	121.7

Literature stripe

literature stripe

Patent stripe

patents stripe