CID 473666

Chembl351554

Structural Information

Molecular Formula
C27H24N4
SMILES
CCCN=C1C=C2C(=NC3=CC=CC=C3N2C4=CC=CC=C4)C=C1NC5=CC=CC=C5
InChI
InChI=1S/C27H24N4/c1-2-17-28-23-19-27-25(18-24(23)29-20-11-5-3-6-12-20)30-22-15-9-10-16-26(22)31(27)21-13-7-4-8-14-21/h3-16,18-19,29H,2,17H2,1H3
InChIKey
FHOHJACZKRPQRQ-UHFFFAOYSA-N
Compound name
N,5-diphenyl-3-propyliminophenazin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

404.2001 Da
Monoisotopic Mass

6.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 405.20738 199.9
[M+Na]+ 427.18932 207.1
[M-H]- 403.19282 208.9
[M+NH4]+ 422.23392 209.0
[M+K]+ 443.16326 197.9
[M+H-H2O]+ 387.19736 186.1
[M+HCOO]- 449.19830 220.7
[M+CH3COO]- 463.21395 208.3
[M+Na-2H]- 425.17477 208.0
[M]+ 404.19955 199.6
[M]- 404.20065 199.6
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

No patent data available for this compound.