CID 44410928

3-(pyridin-4-yl)-1h-indol-6-amine

Structural Information

Molecular Formula
C13H11N3
SMILES
C1=CC2=C(C=C1N)NC=C2C3=CC=NC=C3
InChI
InChI=1S/C13H11N3/c14-10-1-2-11-12(8-16-13(11)7-10)9-3-5-15-6-4-9/h1-8,16H,14H2
InChIKey
NUDVKMUJCFEKEL-UHFFFAOYSA-N
Compound name
3-pyridin-4-yl-1H-indol-6-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

209.09529 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 210.10257 143.5
[M+Na]+ 232.08451 153.8
[M-H]- 208.08801 147.7
[M+NH4]+ 227.12911 161.5
[M+K]+ 248.05845 147.5
[M+H-H2O]+ 192.09255 135.6
[M+HCOO]- 254.09349 166.7
[M+CH3COO]- 268.10914 156.5
[M+Na-2H]- 230.06996 151.3
[M]+ 209.09474 141.7
[M]- 209.09584 141.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.