CID 4913356

2-methyl-1,10-phenanthroline

Structural Information

Molecular Formula
C13H10N2
SMILES
CC1=NC2=C(C=C1)C=CC3=C2N=CC=C3
InChI
InChI=1S/C13H10N2/c1-9-4-5-11-7-6-10-3-2-8-14-12(10)13(11)15-9/h2-8H,1H3
InChIKey
LQZDYPHFVGRHKD-UHFFFAOYSA-N
Compound name
2-methyl-1,10-phenanthroline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

7
References

536
Patents

194.0844 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 195.09168 139.9
[M+Na]+ 217.07362 151.4
[M-H]- 193.07712 143.3
[M+NH4]+ 212.11822 159.0
[M+K]+ 233.04756 146.2
[M+H-H2O]+ 177.08166 131.7
[M+HCOO]- 239.08260 161.5
[M+CH3COO]- 253.09825 153.6
[M+Na-2H]- 215.05907 151.9
[M]+ 194.08385 141.8
[M]- 194.08495 141.8
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