CID 360293

Nsc622328

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]+ 269.09206 160.0
[M+Na]+ 291.07400 168.5
[M-H]- 267.07750 162.8
[M+NH4]+ 286.11860 176.7
[M+K]+ 307.04794 163.2
[M+H-H2O]+ 251.08204 152.3
[M+HCOO]- 313.08298 177.6
[M+CH3COO]- 327.09863 171.0
[M+Na-2H]- 289.05945 164.6
[M]+ 268.08423 158.3
[M]- 268.08533 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