CID 18398273

7-hydroxy-2-oxindole-3-acetic acid

Structural Information

Molecular Formula
C10H9NO4
SMILES
C1=CC2=C(C(=C1)O)NC(=O)C2CC(=O)O
InChI
InChI=1S/C10H9NO4/c12-7-3-1-2-5-6(4-8(13)14)10(15)11-9(5)7/h1-3,6,12H,4H2,(H,11,15)(H,13,14)
InChIKey
RBODBEHKWJZUBG-UHFFFAOYSA-N
Compound name
2-(7-hydroxy-2-oxo-1,3-dihydroindol-3-yl)acetic acid
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

1
References

4
Patents

207.05316 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 208.06044 143.1
[M+Na]+ 230.04238 152.8
[M+NH4]+ 225.08698 149.1
[M+K]+ 246.01632 151.1
[M-H]- 206.04588 141.4
[M+Na-2H]- 228.02783 144.8
[M]+ 207.05261 143.5
[M]- 207.05371 143.5
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

patents stripe