CID 3050031

Cyclohexanemethylamine, 3,3-diphenyl-, maleate (1:1)

Structural Information

Molecular Formula
C19H23N
SMILES
C1CC(CC(C1)(C2=CC=CC=C2)C3=CC=CC=C3)CN
InChI
InChI=1S/C19H23N/c20-15-16-8-7-13-19(14-16,17-9-3-1-4-10-17)18-11-5-2-6-12-18/h1-6,9-12,16H,7-8,13-15,20H2
InChIKey
PEQWMEKVOYUHII-UHFFFAOYSA-N
Compound name
(3,3-diphenylcyclohexyl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

265.18304 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 266.190316 165.1
[M+Na]+ 288.172258 168.9
[M-H]- 264.175764 173.1
[M+NH4]+ 283.216863 182.1
[M+K]+ 304.146198 163.5
[M+H-H2O]+ 248.180300 156.2
[M+HCOO]- 310.181241 185.2
[M+CH3COO]- 324.196891 175.4
[M+Na-2H]- 286.157706 169.3
[M]+ 265.18249142 157.8
[M]- 265.18358858 157.8
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.