CID 3066248

109793-68-2

Structural Information

Molecular Formula
C15H18N2O
SMILES
C1CN(CC=C1C2=CNC3=CC=CC=C32)CCO
InChI
InChI=1S/C15H18N2O/c18-10-9-17-7-5-12(6-8-17)14-11-16-15-4-2-1-3-13(14)15/h1-5,11,16,18H,6-10H2
InChIKey
DWXMFQJVOWOWOL-UHFFFAOYSA-N
Compound name
2-[4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

242.1419 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 243.149176 155.3
[M+Na]+ 265.131118 162.8
[M-H]- 241.134624 157.5
[M+NH4]+ 260.175723 171.6
[M+K]+ 281.105058 156.7
[M+H-H2O]+ 225.139160 147.2
[M+HCOO]- 287.140101 173.1
[M+CH3COO]- 301.155751 166.2
[M+Na-2H]- 263.116566 159.8
[M]+ 242.14135142 152.4
[M]- 242.14244858 152.4
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