CID 10352036

288385-88-6

Structural Information

Molecular Formula
C9H8FNO
SMILES
CC1=CC2=C(N1)C=CC(=C2F)O
InChI
InChI=1S/C9H8FNO/c1-5-4-6-7(11-5)2-3-8(12)9(6)10/h2-4,11-12H,1H3
InChIKey
UMWRMOYYUHIPDT-UHFFFAOYSA-N
Compound name
4-fluoro-2-methyl-1H-indol-5-ol
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

1
References

477
Patents

165.05899 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 166.066266 129.2
[M+Na]+ 188.048208 141.2
[M-H]- 164.051714 129.9
[M+NH4]+ 183.092813 151.0
[M+K]+ 204.022148 136.6
[M+H-H2O]+ 148.056250 123.5
[M+HCOO]- 210.057191 150.9
[M+CH3COO]- 224.072841 143.5
[M+Na-2H]- 186.033656 135.6
[M]+ 165.05844142 128.6
[M]- 165.05953858 128.6
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