CID 3044088

N,n-dimethyl-3,3-diphenylcyclohexylamine hydrochloride

Structural Information

Molecular Formula
C20H25N
SMILES
CN(C)C1CCCC(C1)(C2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C20H25N/c1-21(2)19-14-9-15-20(16-19,17-10-5-3-6-11-17)18-12-7-4-8-13-18/h3-8,10-13,19H,9,14-16H2,1-2H3
InChIKey
QSYAGAFDJLBOAW-UHFFFAOYSA-N
Compound name
N,N-dimethyl-3,3-diphenylcyclohexan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

279.1987 Da
Monoisotopic Mass

5.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 280.20598 168.9
[M+Na]+ 302.18792 172.4
[M-H]- 278.19142 178.6
[M+NH4]+ 297.23252 186.2
[M+K]+ 318.16186 168.5
[M+H-H2O]+ 262.19596 159.5
[M+HCOO]- 324.19690 189.8
[M+CH3COO]- 338.21255 179.6
[M+Na-2H]- 300.17337 172.8
[M]+ 279.19815 164.1
[M]- 279.19925 164.1
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.