CID 131426971

Methyl 4-(2-hydroxyphenyl)-1,3-oxazole-2-carboxylate

Structural Information

Molecular Formula
C11H9NO4
SMILES
COC(=O)C1=NC(=CO1)C2=CC=CC=C2O
InChI
InChI=1S/C11H9NO4/c1-15-11(14)10-12-8(6-16-10)7-4-2-3-5-9(7)13/h2-6,13H,1H3
InChIKey
DJOBIZPBWDWECD-UHFFFAOYSA-N
Compound name
methyl 4-(2-hydroxyphenyl)-1,3-oxazole-2-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

219.05316 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 220.06044 143.8
[M+Na]+ 242.04238 153.0
[M-H]- 218.04588 149.5
[M+NH4]+ 237.08698 160.7
[M+K]+ 258.01632 152.0
[M+H-H2O]+ 202.05042 137.0
[M+HCOO]- 264.05136 166.4
[M+CH3COO]- 278.06701 182.9
[M+Na-2H]- 240.02783 148.8
[M]+ 219.05261 147.0
[M]- 219.05371 147.0
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.