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
2
Annotation Hits

0
References

33
Patents

175.06332 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 176.070596 133.7
[M+Na]+ 198.052538 142.6
[M-H]- 174.056044 138.9
[M+NH4]+ 193.097143 152.4
[M+K]+ 214.026478 140.9
[M+H-H2O]+ 158.060580 127.1
[M+HCOO]- 220.061521 157.0
[M+CH3COO]- 234.077171 147.9
[M+Na-2H]- 196.037986 141.1
[M]+ 175.06277142 134.7
[M]- 175.06386858 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