CID 58598201

874348-19-3

Structural Information

Molecular Formula

C₁₀H₂₂N₂

SMILES

CN(C)C[C@H](C1CCCCC1)N

InChI

InChI=1S/C10H22N2/c1-12(2)8-10(11)9-6-4-3-5-7-9/h9-10H,3-8,11H2,1-2H3/t10-/m1/s1

InChIKey

IXMISKMRXSRNAV-SNVBAGLBSA-N

Compound name

(1S)-1-cyclohexyl-N',N'-dimethylethane-1,2-diamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 3
Patents: 170.1783 Da
Monoisotopic Mass: 1.8
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]+	171.185576	142.9
[M+Na]+	193.167518	144.9
[M-H]-	169.171024	146.0
[M+NH4]+	188.212123	162.7
[M+K]+	209.141458	144.9
[M+H-H2O]+	153.175560	136.3
[M+HCOO]-	215.176501	163.6
[M+CH3COO]-	229.192151	188.9
[M+Na-2H]-	191.152966	144.9
[M]+	170.17775142	136.9
[M]-	170.17884858	136.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe