CID 3041365

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

Structural Information

Molecular Formula
C10H10N2O2
SMILES
CC1=CC=C(C=C1)C2=NN=C(O2)CO
InChI
InChI=1S/C10H10N2O2/c1-7-2-4-8(5-3-7)10-12-11-9(6-13)14-10/h2-5,13H,6H2,1H3
InChIKey
NKZFJQXLZIQHGS-UHFFFAOYSA-N
Compound name
[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

28
Patents

190.07423 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 191.08151 139.3
[M+Na]+ 213.06345 153.3
[M+NH4]+ 208.10805 147.1
[M+K]+ 229.03739 149.4
[M-H]- 189.06695 142.8
[M+Na-2H]- 211.04890 146.8
[M]+ 190.07368 142.3
[M]- 190.07478 142.3
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