CID 18364430

1048918-81-5

Structural Information

Molecular Formula

C₉H₂₀N₂

SMILES

CNC1CCC(CC1)N(C)C

InChI

InChI=1S/C9H20N2/c1-10-8-4-6-9(7-5-8)11(2)3/h8-10H,4-7H2,1-3H3

InChIKey

HJANWHMCHVPVJK-UHFFFAOYSA-N

Compound name

1-N,4-N,4-N-trimethylcyclohexane-1,4-diamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 70
Patents: 156.16264 Da
Monoisotopic Mass: 1.2
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]+	157.16992	137.1
[M+Na]+	179.15186	146.4
[M+NH4]+	174.19646	146.4
[M+K]+	195.12580	140.3
[M-H]-	155.15536	140.9
[M+Na-2H]-	177.13731	142.6
[M]+	156.16209	139.3
[M]-	156.16319	139.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe