CID 203640

14845-00-2

Structural Information

Molecular Formula
C16H18N2
SMILES
CC1CC2=CC=CC=C2N1CCC3=CC=NC=C3
InChI
InChI=1S/C16H18N2/c1-13-12-15-4-2-3-5-16(15)18(13)11-8-14-6-9-17-10-7-14/h2-7,9-10,13H,8,11-12H2,1H3
InChIKey
WQWBHHIWWNYPNK-UHFFFAOYSA-N
Compound name
2-methyl-1-(2-pyridin-4-ylethyl)-2,3-dihydroindole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

238.147 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 239.15428 156.5
[M+Na]+ 261.13622 171.4
[M+NH4]+ 256.18082 166.1
[M+K]+ 277.11016 164.0
[M-H]- 237.13972 161.0
[M+Na-2H]- 259.12167 164.9
[M]+ 238.14645 160.0
[M]- 238.14755 160.0
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

No patent data available for this compound.