CID 3042762

Brn 1132476

Structural Information

Molecular Formula
C15H13N3O2
SMILES
C1=CC=C(C=C1)C2=CC=C(C=C2)C(C3=NOC(=N3)N)O
InChI
InChI=1S/C15H13N3O2/c16-15-17-14(18-20-15)13(19)12-8-6-11(7-9-12)10-4-2-1-3-5-10/h1-9,13,19H,(H2,16,17,18)
InChIKey
WCQUMEGSDXPPMD-UHFFFAOYSA-N
Compound name
(5-amino-1,2,4-oxadiazol-3-yl)-(4-phenylphenyl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

267.10077 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 268.10805 160.7
[M+Na]+ 290.08999 174.6
[M+NH4]+ 285.13459 168.0
[M+K]+ 306.06393 170.6
[M-H]- 266.09349 166.8
[M+Na-2H]- 288.07544 169.8
[M]+ 267.10022 164.3
[M]- 267.10132 164.3
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

No patent data available for this compound.