CID 19885843

Schembl239294

Structural Information

Molecular Formula

C₈H₂₀N

SMILES

CC(C)[N+](C)(C)C(C)C

InChI

InChI=1S/C8H20N/c1-7(2)9(5,6)8(3)4/h7-8H,1-6H3/q+1

InChIKey

GJZAMOYERKVOGF-UHFFFAOYSA-N

Compound name

dimethyl-di(propan-2-yl)azanium

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 548
Patents: 130.15958 Da
Monoisotopic Mass: 1.9
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]+	131.166856	127.2
[M+Na]+	153.148798	133.3
[M-H]-	129.152304	129.4
[M+NH4]+	148.193403	150.1
[M+K]+	169.122738	129.3
[M+H-H2O]+	113.156840	126.0
[M+HCOO]-	175.157781	149.0
[M+CH3COO]-	189.173431	176.3
[M+Na-2H]-	151.134246	134.7
[M]+	130.15903142	126.9
[M]-	130.16012858	126.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe