CID 14477

N-tert-butyl-1,1-dimethylallylamine

Structural Information

Molecular Formula

C₉H₁₉N

SMILES

CC(C)(C)NC(C)(C)C=C

InChI

InChI=1S/C9H19N/c1-7-9(5,6)10-8(2,3)4/h7,10H,1H2,2-6H3

InChIKey

SXGXCSASZBCDRM-UHFFFAOYSA-N

Compound name

N-tert-butyl-2-methylbut-3-en-2-amine

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 15
Patents: 141.15175 Da
Monoisotopic Mass: 2.0
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]+	142.15903	135.6
[M+Na]+	164.14097	144.8
[M+NH4]+	159.18557	143.4
[M+K]+	180.11491	139.9
[M-H]-	140.14447	135.0
[M+Na-2H]-	162.12642	139.4
[M]+	141.15120	136.7
[M]-	141.15230	136.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe