CID 15555156

59398-98-0

Structural Information

Molecular Formula
C10H9NO2
SMILES
C1=CC=C(C=C1)C2=NC(=CO2)CO
InChI
InChI=1S/C10H9NO2/c12-6-9-7-13-10(11-9)8-4-2-1-3-5-8/h1-5,7,12H,6H2
InChIKey
FSDBXQYHHCUEIE-UHFFFAOYSA-N
Compound name
(2-phenyl-1,3-oxazol-4-yl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

26
Patents

175.06332 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 176.07060 133.7
[M+Na]+ 198.05254 142.6
[M-H]- 174.05604 138.9
[M+NH4]+ 193.09714 152.4
[M+K]+ 214.02648 140.9
[M+H-H2O]+ 158.06058 127.1
[M+HCOO]- 220.06152 157.0
[M+CH3COO]- 234.07717 147.9
[M+Na-2H]- 196.03799 141.1
[M]+ 175.06277 134.7
[M]- 175.06387 134.7
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