CID 3040472

N-cyclohexyl-2-phenyl-1h-indole-3-methanamine

Structural Information

Molecular Formula
C21H24N2
SMILES
C1CCC(CC1)NCC2=C(NC3=CC=CC=C32)C4=CC=CC=C4
InChI
InChI=1S/C21H24N2/c1-3-9-16(10-4-1)21-19(15-22-17-11-5-2-6-12-17)18-13-7-8-14-20(18)23-21/h1,3-4,7-10,13-14,17,22-23H,2,5-6,11-12,15H2
InChIKey
GJERGCXATPSWTI-UHFFFAOYSA-N
Compound name
N-[(2-phenyl-1H-indol-3-yl)methyl]cyclohexanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

304.19394 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 305.201216 171.1
[M+Na]+ 327.183158 175.8
[M-H]- 303.186664 178.1
[M+NH4]+ 322.227763 185.8
[M+K]+ 343.157098 168.2
[M+H-H2O]+ 287.191200 161.6
[M+HCOO]- 349.192141 190.4
[M+CH3COO]- 363.207791 180.8
[M+Na-2H]- 325.168606 174.7
[M]+ 304.19339142 165.4
[M]- 304.19448858 165.4
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.