CID 129969500

3-(4-fluorophenyl)-5-methyl-1,2-oxazol-4-ol

Structural Information

Molecular Formula
C10H8FNO2
SMILES
CC1=C(C(=NO1)C2=CC=C(C=C2)F)O
InChI
InChI=1S/C10H8FNO2/c1-6-10(13)9(12-14-6)7-2-4-8(11)5-3-7/h2-5,13H,1H3
InChIKey
XJUXLUNTHAJJMH-UHFFFAOYSA-N
Compound name
3-(4-fluorophenyl)-5-methyl-1,2-oxazol-4-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

193.05391 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 194.06119 136.1
[M+Na]+ 216.04313 147.0
[M-H]- 192.04663 140.8
[M+NH4]+ 211.08773 154.7
[M+K]+ 232.01707 144.8
[M+H-H2O]+ 176.05117 129.1
[M+HCOO]- 238.05211 158.4
[M+CH3COO]- 252.06776 180.1
[M+Na-2H]- 214.02858 141.5
[M]+ 193.05336 136.9
[M]- 193.05446 136.9
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

No patent data available for this compound.