CID 10462298

4,7-dimethoxy-1,10-phenanthroline

Structural Information

Molecular Formula
C14H12N2O2
SMILES
COC1=C2C=CC3=C(C=CN=C3C2=NC=C1)OC
InChI
InChI=1S/C14H12N2O2/c1-17-11-5-7-15-13-9(11)3-4-10-12(18-2)6-8-16-14(10)13/h3-8H,1-2H3
InChIKey
ZPGVCQYKXIQWTP-UHFFFAOYSA-N
Compound name
4,7-dimethoxy-1,10-phenanthroline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

2264
Patents

240.08987 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 241.097146 151.8
[M+Na]+ 263.079088 163.5
[M-H]- 239.082594 155.4
[M+NH4]+ 258.123693 169.2
[M+K]+ 279.053028 159.3
[M+H-H2O]+ 223.087130 143.1
[M+HCOO]- 285.088071 173.4
[M+CH3COO]- 299.103721 165.0
[M+Na-2H]- 261.064536 162.5
[M]+ 240.08932142 157.2
[M]- 240.09041858 157.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe