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

1
Patents

265.18304 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 266.19032 164.0
[M+Na]+ 288.17226 168.9
[M-H]- 264.17576 173.1
[M+NH4]+ 283.21686 183.4
[M+K]+ 304.14620 163.6
[M+H-H2O]+ 248.18030 155.8
[M+HCOO]- 310.18124 187.2
[M+CH3COO]- 324.19689 175.5
[M+Na-2H]- 286.15771 167.8
[M]+ 265.18249 160.1
[M]- 265.18359 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