CID 3068359

83363-39-7

Structural Information

Molecular Formula
C16H18N2
SMILES
C=CCN1CCC=C(C1)C2=C3C=CNC3=CC=C2
InChI
InChI=1S/C16H18N2/c1-2-10-18-11-4-5-13(12-18)14-6-3-7-16-15(14)8-9-17-16/h2-3,5-9,17H,1,4,10-12H2
InChIKey
HMNMNVKKGHIFLH-UHFFFAOYSA-N
Compound name
4-(1-prop-2-enyl-3,6-dihydro-2H-pyridin-5-yl)-1H-indole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

238.147 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 239.15428 156.5
[M+Na]+ 261.13622 171.0
[M+NH4]+ 256.18082 165.6
[M+K]+ 277.11016 163.8
[M-H]- 237.13972 160.3
[M+Na-2H]- 259.12167 164.3
[M]+ 238.14645 159.7
[M]- 238.14755 159.7
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