CID 3041370

1,3,4-oxadiazole-2-methanol, 5-(3,4-dichlorophenyl)-

Structural Information

Molecular Formula
C9H6Cl2N2O2
SMILES
C1=CC(=C(C=C1C2=NN=C(O2)CO)Cl)Cl
InChI
InChI=1S/C9H6Cl2N2O2/c10-6-2-1-5(3-7(6)11)9-13-12-8(4-14)15-9/h1-3,14H,4H2
InChIKey
PMGFUMGGHUYEEU-UHFFFAOYSA-N
Compound name
[5-(3,4-dichlorophenyl)-1,3,4-oxadiazol-2-yl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

243.98064 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 244.98792 146.9
[M+Na]+ 266.96986 162.6
[M+NH4]+ 262.01446 155.1
[M+K]+ 282.94380 157.5
[M-H]- 242.97336 150.3
[M+Na-2H]- 264.95531 154.3
[M]+ 243.98009 150.7
[M]- 243.98119 150.7
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