CID 3044123

Cyclohexanamine, 4,4-diphenyl-1-methyl-, hydrochloride

Structural Information

Molecular Formula
C19H23N
SMILES
CC1(CCC(CC1)(C2=CC=CC=C2)C3=CC=CC=C3)N
InChI
InChI=1S/C19H23N/c1-18(20)12-14-19(15-13-18,16-8-4-2-5-9-16)17-10-6-3-7-11-17/h2-11H,12-15,20H2,1H3
InChIKey
AKSDVHRKWJBWJV-UHFFFAOYSA-N
Compound name
1-methyl-4,4-diphenylcyclohexan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

265.18304 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 266.190316 165.5
[M+Na]+ 288.172258 170.5
[M-H]- 264.175764 174.0
[M+NH4]+ 283.216863 184.7
[M+K]+ 304.146198 165.4
[M+H-H2O]+ 248.180300 156.9
[M+HCOO]- 310.181241 185.7
[M+CH3COO]- 324.196891 176.3
[M+Na-2H]- 286.157706 170.7
[M]+ 265.18249142 158.7
[M]- 265.18358858 158.7
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

patents stripe