CID 6650

1,8-diamino-p-menthane

Structural Information

Molecular Formula

C₁₀H₂₂N₂

SMILES

CC1(CCC(CC1)C(C)(C)N)N

InChI

InChI=1S/C10H22N2/c1-9(2,11)8-4-6-10(3,12)7-5-8/h8H,4-7,11-12H2,1-3H3

InChIKey

KOGSPLLRMRSADR-UHFFFAOYSA-N

Compound name

4-(2-aminopropan-2-yl)-1-methylcyclohexan-1-amine

Related CIDs

2D Structure

compound 2d structure

3
Annotation Hits: 2
References: 5972
Patents: 170.1783 Da
Monoisotopic Mass: 0.7
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]+	171.18558	140.5
[M+Na]+	193.16752	148.5
[M+NH4]+	188.21212	150.3
[M+K]+	209.14146	141.9
[M-H]-	169.17102	142.8
[M+Na-2H]-	191.15297	146.1
[M]+	170.17775	142.2
[M]-	170.17885	142.2

Literature stripe

literature stripe

Patent stripe

patents stripe