CID 25849

N,n-dimethyl-2-((2-methyl-1-o-tolylcyclohexyl)oxy)ethylamine hydrochloride

Structural Information

Molecular Formula
C18H29NO
SMILES
CC1CCCCC1(C2=CC=CC=C2C)OCCN(C)C
InChI
InChI=1S/C18H29NO/c1-15-9-5-6-11-17(15)18(20-14-13-19(3)4)12-8-7-10-16(18)2/h5-6,9,11,16H,7-8,10,12-14H2,1-4H3
InChIKey
IHOFWADEBKHGQZ-UHFFFAOYSA-N
Compound name
N,N-dimethyl-2-[2-methyl-1-(2-methylphenyl)cyclohexyl]oxyethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

275.2249 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 276.232176 168.5
[M+Na]+ 298.214118 172.4
[M-H]- 274.217624 175.5
[M+NH4]+ 293.258723 187.0
[M+K]+ 314.188058 170.4
[M+H-H2O]+ 258.222160 160.8
[M+HCOO]- 320.223101 189.0
[M+CH3COO]- 334.238751 207.2
[M+Na-2H]- 296.199566 170.7
[M]+ 275.22435142 167.7
[M]- 275.22544858 167.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.