CID 59560

Dtxsid201040445

Structural Information

Molecular Formula
C15H14N4O
SMILES
C1COC(=N1)NC2=CC=C(C=C2)N=NC3=CC=CC=C3
InChI
InChI=1S/C15H14N4O/c1-2-4-13(5-3-1)18-19-14-8-6-12(7-9-14)17-15-16-10-11-20-15/h1-9H,10-11H2,(H,16,17)
InChIKey
SZVLYRDSVSNTOV-UHFFFAOYSA-N
Compound name
N-(4-phenyldiazenylphenyl)-4,5-dihydro-1,3-oxazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

266.11676 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 267.124036 157.6
[M+Na]+ 289.105978 163.7
[M-H]- 265.109484 169.2
[M+NH4]+ 284.150583 172.9
[M+K]+ 305.079918 161.5
[M+H-H2O]+ 249.114020 147.4
[M+HCOO]- 311.114961 186.6
[M+CH3COO]- 325.130611 170.4
[M+Na-2H]- 287.091426 166.3
[M]+ 266.11621142 157.5
[M]- 266.11730858 157.5
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.