CID 82572

6,13-dihydrodibenzo(b,i)phenazine

Structural Information

Molecular Formula
C20H14N2
SMILES
C1=CC=C2C=C3C(=CC2=C1)NC4=CC5=CC=CC=C5C=C4N3
InChI
InChI=1S/C20H14N2/c1-2-6-14-10-18-17(9-13(14)5-1)21-19-11-15-7-3-4-8-16(15)12-20(19)22-18/h1-12,21-22H
InChIKey
WEZBHKGNUIINBQ-UHFFFAOYSA-N
Compound name
2,13-diazapentacyclo[12.8.0.03,12.05,10.016,21]docosa-1(22),3,5,7,9,11,14,16,18,20-decaene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

27
Patents

282.1157 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 283.12298 162.2
[M+Na]+ 305.10492 171.9
[M-H]- 281.10842 164.0
[M+NH4]+ 300.14952 177.6
[M+K]+ 321.07886 162.2
[M+H-H2O]+ 265.11296 152.3
[M+HCOO]- 327.11390 176.0
[M+CH3COO]- 341.12955 172.2
[M+Na-2H]- 303.09037 173.6
[M]+ 282.11515 159.0
[M]- 282.11625 159.0
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