CID 67227038

6-fluoro-4-methoxy-1h-indole-2-carboxylic acid

Structural Information

Molecular Formula
C10H8FNO3
SMILES
COC1=CC(=CC2=C1C=C(N2)C(=O)O)F
InChI
InChI=1S/C10H8FNO3/c1-15-9-3-5(11)2-7-6(9)4-8(12-7)10(13)14/h2-4,12H,1H3,(H,13,14)
InChIKey
FMYHJHUNKLAGJB-UHFFFAOYSA-N
Compound name
6-fluoro-4-methoxy-1H-indole-2-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

63
Patents

209.04883 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 210.05611 141.8
[M+Na]+ 232.03805 153.4
[M+NH4]+ 227.08265 148.4
[M+K]+ 248.01199 150.5
[M-H]- 208.04155 140.3
[M+Na-2H]- 230.02350 145.7
[M]+ 209.04828 142.7
[M]- 209.04938 142.7
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