CID 3049979

Methylaminomethyl-3,3-diphenylcyclohexane hydrochloride

Structural Information

Molecular Formula
C20H25N
SMILES
CNCC1CCCC(C1)(C2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C20H25N/c1-21-16-17-9-8-14-20(15-17,18-10-4-2-5-11-18)19-12-6-3-7-13-19/h2-7,10-13,17,21H,8-9,14-16H2,1H3
InChIKey
JLRVCIXAVQQMGF-UHFFFAOYSA-N
Compound name
1-(3,3-diphenylcyclohexyl)-N-methylmethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

279.1987 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 280.20598 171.3
[M+Na]+ 302.18792 185.6
[M+NH4]+ 297.23252 183.0
[M+K]+ 318.16186 173.3
[M-H]- 278.19142 179.8
[M+Na-2H]- 300.17337 183.8
[M]+ 279.19815 176.1
[M]- 279.19925 176.1
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.