CID 300765

2-(5-phenyl-1,3,4-oxadiazol-2-yl)phenol

Structural Information

Molecular Formula
C14H10N2O2
SMILES
C1=CC=C(C=C1)C2=NN=C(O2)C3=CC=CC=C3O
InChI
InChI=1S/C14H10N2O2/c17-12-9-5-4-8-11(12)14-16-15-13(18-14)10-6-2-1-3-7-10/h1-9,17H
InChIKey
AXKJOWVRUHGNBD-UHFFFAOYSA-N
Compound name
2-(5-phenyl-1,3,4-oxadiazol-2-yl)phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

180
Patents

238.07423 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 239.081506 150.4
[M+Na]+ 261.063448 159.8
[M-H]- 237.066954 157.6
[M+NH4]+ 256.108053 164.7
[M+K]+ 277.037388 156.2
[M+H-H2O]+ 221.071490 141.5
[M+HCOO]- 283.072431 172.2
[M+CH3COO]- 297.088081 163.3
[M+Na-2H]- 259.048896 156.8
[M]+ 238.07368142 151.0
[M]- 238.07477858 151.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe