CID 217780

39617-58-8

Structural Information

Molecular Formula
C19H23N
SMILES
CNCC1CCC(C1)(C2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C19H23N/c1-20-15-16-12-13-19(14-16,17-8-4-2-5-9-17)18-10-6-3-7-11-18/h2-11,16,20H,12-15H2,1H3
InChIKey
ATGKSTRWVLVOOX-UHFFFAOYSA-N
Compound name
1-(3,3-diphenylcyclopentyl)-N-methylmethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
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 164.0
[M+Na]+ 288.172258 168.9
[M-H]- 264.175764 173.1
[M+NH4]+ 283.216863 183.4
[M+K]+ 304.146198 163.6
[M+H-H2O]+ 248.180300 155.8
[M+HCOO]- 310.181241 187.2
[M+CH3COO]- 324.196891 175.5
[M+Na-2H]- 286.157706 167.8
[M]+ 265.18249142 160.1
[M]- 265.18358858 160.1
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

patents stripe