CID 21409914

749788-73-6

Structural Information

Molecular Formula

C₇H₁₈N₂

SMILES

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

InChI

InChI=1S/C7H18N2/c1-7(2,6-8-3)9(4)5/h8H,6H2,1-5H3

InChIKey

WWBYIFXSSNNBBW-UHFFFAOYSA-N

Compound name

1-N,2-N,2-N,2-tetramethylpropane-1,2-diamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 29
Patents: 130.147 Da
Monoisotopic Mass: 0.5
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]+	131.15428	131.2
[M+Na]+	153.13622	137.0
[M-H]-	129.13972	133.1
[M+NH4]+	148.18082	153.7
[M+K]+	169.11016	138.2
[M+H-H2O]+	113.14426	126.4
[M+HCOO]-	175.14520	155.7
[M+CH3COO]-	189.16085	183.8
[M+Na-2H]-	151.12167	138.0
[M]+	130.14645	132.0
[M]-	130.14755	132.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe