CID 51072308

915922-16-6

Structural Information

Molecular Formula
C10H8FNO3
SMILES
C1=CC2=C(C=C1F)NC(=O)C2CC(=O)O
InChI
InChI=1S/C10H8FNO3/c11-5-1-2-6-7(4-9(13)14)10(15)12-8(6)3-5/h1-3,7H,4H2,(H,12,15)(H,13,14)
InChIKey
KKGBSHPZFPPKHD-UHFFFAOYSA-N
Compound name
2-(6-fluoro-2-oxo-1,3-dihydroindol-3-yl)acetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

17
Patents

209.04883 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 210.05611 140.9
[M+Na]+ 232.03805 150.3
[M-H]- 208.04155 140.7
[M+NH4]+ 227.08265 160.2
[M+K]+ 248.01199 146.3
[M+H-H2O]+ 192.04609 134.8
[M+HCOO]- 254.04703 159.0
[M+CH3COO]- 268.06268 181.1
[M+Na-2H]- 230.02350 143.6
[M]+ 209.04828 138.5
[M]- 209.04938 138.5
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