CID 57370570

173-86-4

Structural Information

Molecular Formula
C13H10N2O
SMILES
C1C2=C(C=CC=N2)C3=C(C14CO4)N=CC=C3
InChI
InChI=1S/C13H10N2O/c1-3-9-10-4-2-6-15-12(10)13(8-16-13)7-11(9)14-5-1/h1-6H,7-8H2
InChIKey
FWRZHGXFKWGHCP-UHFFFAOYSA-N
Compound name
spiro[5H-4,7-phenanthroline-6,2'-oxirane]
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

210.07932 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 211.08660 150.7
[M+Na]+ 233.06854 168.8
[M+NH4]+ 228.11314 163.0
[M+K]+ 249.04248 159.7
[M-H]- 209.07204 163.3
[M+Na-2H]- 231.05399 162.3
[M]+ 210.07877 158.5
[M]- 210.07987 158.5
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.