CID 43558727

[5-(4-fluorophenyl)-1,3-oxazol-2-yl]methanol

Structural Information

Molecular Formula
C10H8FNO2
SMILES
C1=CC(=CC=C1C2=CN=C(O2)CO)F
InChI
InChI=1S/C10H8FNO2/c11-8-3-1-7(2-4-8)9-5-12-10(6-13)14-9/h1-5,13H,6H2
InChIKey
YAWZQZYIGAJDAT-UHFFFAOYSA-N
Compound name
[5-(4-fluorophenyl)-1,3-oxazol-2-yl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

9
Patents

193.05391 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 194.06119 136.3
[M+Na]+ 216.04313 146.1
[M-H]- 192.04663 140.5
[M+NH4]+ 211.08773 154.4
[M+K]+ 232.01707 143.9
[M+H-H2O]+ 176.05117 128.9
[M+HCOO]- 238.05211 158.5
[M+CH3COO]- 252.06776 178.9
[M+Na-2H]- 214.02858 142.3
[M]+ 193.05336 136.6
[M]- 193.05446 136.6
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