CID 16769814

[5-(2-chlorophenyl)-1,3,4-oxadiazol-2-yl]methanol

Structural Information

Molecular Formula
C9H7ClN2O2
SMILES
C1=CC=C(C(=C1)C2=NN=C(O2)CO)Cl
InChI
InChI=1S/C9H7ClN2O2/c10-7-4-2-1-3-6(7)9-12-11-8(5-13)14-9/h1-4,13H,5H2
InChIKey
KVNIWYBESKWXTD-UHFFFAOYSA-N
Compound name
[5-(2-chlorophenyl)-1,3,4-oxadiazol-2-yl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

210.0196 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 211.02688 140.7
[M+Na]+ 233.00882 155.6
[M+NH4]+ 228.05342 148.8
[M+K]+ 248.98276 151.1
[M-H]- 209.01232 144.2
[M+Na-2H]- 230.99427 148.4
[M]+ 210.01905 144.1
[M]- 210.02015 144.1
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.