CID 3041371

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

Structural Information

Molecular Formula
C10H10N2O3
SMILES
COC1=CC=C(C=C1)C2=NN=C(O2)CO
InChI
InChI=1S/C10H10N2O3/c1-14-8-4-2-7(3-5-8)10-12-11-9(6-13)15-10/h2-5,13H,6H2,1H3
InChIKey
NYWFODASCTYGIQ-UHFFFAOYSA-N
Compound name
[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

206.06914 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 207.07642 141.2
[M+Na]+ 229.05836 150.9
[M-H]- 205.06186 145.4
[M+NH4]+ 224.10296 157.4
[M+K]+ 245.03230 149.5
[M+H-H2O]+ 189.06640 133.6
[M+HCOO]- 251.06734 163.3
[M+CH3COO]- 265.08299 181.1
[M+Na-2H]- 227.04381 147.7
[M]+ 206.06859 144.5
[M]- 206.06969 144.5
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.