CID 217776

39617-55-5

Structural Information

Molecular Formula
C19H22ClN
SMILES
CN(C)C1CCC(C1)(C2=CC=CC=C2)C3=CC=C(C=C3)Cl
InChI
InChI=1S/C19H22ClN/c1-21(2)18-12-13-19(14-18,15-6-4-3-5-7-15)16-8-10-17(20)11-9-16/h3-11,18H,12-14H2,1-2H3
InChIKey
NRYVCTOVIGJFOK-UHFFFAOYSA-N
Compound name
3-(4-chlorophenyl)-N,N-dimethyl-3-phenylcyclopentan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

299.14407 Da
Monoisotopic Mass

5.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 300.15135 171.9
[M+Na]+ 322.13329 186.6
[M+NH4]+ 317.17789 184.0
[M+K]+ 338.10723 176.6
[M-H]- 298.13679 180.0
[M+Na-2H]- 320.11874 183.7
[M]+ 299.14352 177.0
[M]- 299.14462 177.0
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