CID 52274

73713-70-9

Structural Information

Molecular Formula
C19H16N2O2
SMILES
CCOC(=O)C1=CC2=C(C=C1)NC3=CC4=CC=CC=C4C=C3N2
InChI
InChI=1S/C19H16N2O2/c1-2-23-19(22)14-7-8-15-16(11-14)21-18-10-13-6-4-3-5-12(13)9-17(18)20-15/h3-11,20-21H,2H2,1H3
InChIKey
GYLHYTYYERUYLF-UHFFFAOYSA-N
Compound name
ethyl 5,12-dihydrobenzo[b]phenazine-3-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

304.1212 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 305.128476 170.2
[M+Na]+ 327.110418 177.8
[M-H]- 303.113924 170.6
[M+NH4]+ 322.155023 183.8
[M+K]+ 343.084358 170.6
[M+H-H2O]+ 287.118460 161.0
[M+HCOO]- 349.119401 182.9
[M+CH3COO]- 363.135051 179.2
[M+Na-2H]- 325.095866 177.3
[M]+ 304.12065142 168.1
[M]- 304.12174858 168.1
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.