CID 25056

Indoline, 1-(2-(4-pyridyl)ethyl)-

Structural Information

Molecular Formula
C15H16N2
SMILES
C1CN(C2=CC=CC=C21)CCC3=CC=NC=C3
InChI
InChI=1S/C15H16N2/c1-2-4-15-14(3-1)8-12-17(15)11-7-13-5-9-16-10-6-13/h1-6,9-10H,7-8,11-12H2
InChIKey
FTGIWLFSDZPQIO-UHFFFAOYSA-N
Compound name
1-(2-pyridin-4-ylethyl)-2,3-dihydroindole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1078
Patents

224.13135 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 225.138626 151.1
[M+Na]+ 247.120568 158.6
[M-H]- 223.124074 155.5
[M+NH4]+ 242.165173 169.1
[M+K]+ 263.094508 153.7
[M+H-H2O]+ 207.128610 142.1
[M+HCOO]- 269.129551 171.7
[M+CH3COO]- 283.145201 163.1
[M+Na-2H]- 245.106016 157.1
[M]+ 224.13080142 150.0
[M]- 224.13189858 150.0
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