CID 3040471

Brn 0432555

Structural Information

Molecular Formula
C21H24N2
SMILES
CC1=CC=C(C=C1)C2=C(C3=CC=CC=C3N2)CNC4CCCC4
InChI
InChI=1S/C21H24N2/c1-15-10-12-16(13-11-15)21-19(14-22-17-6-2-3-7-17)18-8-4-5-9-20(18)23-21/h4-5,8-13,17,22-23H,2-3,6-7,14H2,1H3
InChIKey
PSEQPRGUVDLXLS-UHFFFAOYSA-N
Compound name
N-[[2-(4-methylphenyl)-1H-indol-3-yl]methyl]cyclopentanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

304.19394 Da
Monoisotopic Mass

4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 305.20122 175.0
[M+Na]+ 327.18316 188.6
[M+NH4]+ 322.22776 184.6
[M+K]+ 343.15710 182.7
[M-H]- 303.18666 181.9
[M+Na-2H]- 325.16861 183.6
[M]+ 304.19339 178.9
[M]- 304.19449 178.9
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.