CID 360293

3-hydroxy-3-(2-oxo-2-pyridin-4-ylethyl)-1h-indol-2-one

Structural Information

Molecular Formula
C15H12N2O3
SMILES
C1=CC=C2C(=C1)C(C(=O)N2)(CC(=O)C3=CC=NC=C3)O
InChI
InChI=1S/C15H12N2O3/c18-13(10-5-7-16-8-6-10)9-15(20)11-3-1-2-4-12(11)17-14(15)19/h1-8,20H,9H2,(H,17,19)
InChIKey
PWCSGWWCYIKEJI-UHFFFAOYSA-N
Compound name
3-hydroxy-3-(2-oxo-2-pyridin-4-ylethyl)-1H-indol-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

268.08478 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 269.092056 160.0
[M+Na]+ 291.073998 168.5
[M-H]- 267.077504 162.8
[M+NH4]+ 286.118603 176.7
[M+K]+ 307.047938 163.2
[M+H-H2O]+ 251.082040 152.3
[M+HCOO]- 313.082981 177.6
[M+CH3COO]- 327.098631 171.0
[M+Na-2H]- 289.059446 164.6
[M]+ 268.08423142 158.3
[M]- 268.08532858 158.3
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