CID 152215

1h-indole, 3-(1-methyl-1,2,3,6-tetrahydro-4-pyridinyl)-, monohydrochloride

Structural Information

Molecular Formula
C14H16N2
SMILES
CN1CCC(=CC1)C2=CNC3=CC=CC=C32
InChI
InChI=1S/C14H16N2/c1-16-8-6-11(7-9-16)13-10-15-14-5-3-2-4-12(13)14/h2-6,10,15H,7-9H2,1H3
InChIKey
IUENQRYBZHHPBN-UHFFFAOYSA-N
Compound name
3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

11
References

22
Patents

212.13135 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 213.13863 148.1
[M+Na]+ 235.12057 162.9
[M+NH4]+ 230.16517 157.7
[M+K]+ 251.09451 156.3
[M-H]- 211.12407 152.2
[M+Na-2H]- 233.10602 156.4
[M]+ 212.13080 151.4
[M]- 212.13190 151.4
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

patents stripe