CID 389066

Nsc684705

Structural Information

Molecular Formula
C17H13N3O2
SMILES
CC1=C(C2=NC=CC(=O)C2=C3C1=NC4=CC=CC=C4N3)OC
InChI
InChI=1S/C17H13N3O2/c1-9-14-15(20-11-6-4-3-5-10(11)19-14)13-12(21)7-8-18-16(13)17(9)22-2/h3-8,20H,1-2H3
InChIKey
QLYVSONKHGZXCT-UHFFFAOYSA-N
Compound name
5-methoxy-6-methyl-12H-pyrido[3,2-a]phenazin-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

291.10077 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 292.108046 167.9
[M+Na]+ 314.089988 181.0
[M-H]- 290.093494 170.1
[M+NH4]+ 309.134593 182.2
[M+K]+ 330.063928 173.7
[M+H-H2O]+ 274.098030 158.0
[M+HCOO]- 336.098971 185.1
[M+CH3COO]- 350.114621 179.3
[M+Na-2H]- 312.075436 177.8
[M]+ 291.10022142 171.7
[M]- 291.10131858 171.7
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.