CID 74265

3,4,7,8-tetramethyl-1,10-phenanthroline

Structural Information

Molecular Formula
C16H16N2
SMILES
CC1=CN=C2C(=C1C)C=CC3=C(C(=CN=C32)C)C
InChI
InChI=1S/C16H16N2/c1-9-7-17-15-13(11(9)3)5-6-14-12(4)10(2)8-18-16(14)15/h5-8H,1-4H3
InChIKey
NPAXPTHCUCUHPT-UHFFFAOYSA-N
Compound name
3,4,7,8-tetramethyl-1,10-phenanthroline
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

44
References

2707
Patents

236.13135 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 237.13863 154.3
[M+Na]+ 259.12057 173.3
[M+NH4]+ 254.16517 164.5
[M+K]+ 275.09451 163.5
[M-H]- 235.12407 158.8
[M+Na-2H]- 257.10602 163.1
[M]+ 236.13080 158.8
[M]- 236.13190 158.8
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