CID 26935

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

Structural Information

Molecular Formula
C15H16N2
SMILES
C1CN(C2=CC=CC=C21)CCC3=CC=CC=N3
InChI
InChI=1S/C15H16N2/c1-2-7-15-13(5-1)8-11-17(15)12-9-14-6-3-4-10-16-14/h1-7,10H,8-9,11-12H2
InChIKey
JZHBBTBIFNAYGW-UHFFFAOYSA-N
Compound name
1-(2-pyridin-2-ylethyl)-2,3-dihydroindole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

224.13135 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 225.13863 151.1
[M+Na]+ 247.12057 158.6
[M-H]- 223.12407 155.5
[M+NH4]+ 242.16517 169.1
[M+K]+ 263.09451 153.7
[M+H-H2O]+ 207.12861 142.1
[M+HCOO]- 269.12955 171.7
[M+CH3COO]- 283.14520 163.1
[M+Na-2H]- 245.10602 157.1
[M]+ 224.13080 150.0
[M]- 224.13190 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

literature stripe

Patent stripe

No patent data available for this compound.