CID 473670

(3z)-3-pentylimino-n,5-diphenyl-phenazin-2-amine

Structural Information

Molecular Formula
C29H28N4
SMILES
CCCCCN=C1C=C2C(=NC3=CC=CC=C3N2C4=CC=CC=C4)C=C1NC5=CC=CC=C5
InChI
InChI=1S/C29H28N4/c1-2-3-12-19-30-25-21-29-27(20-26(25)31-22-13-6-4-7-14-22)32-24-17-10-11-18-28(24)33(29)23-15-8-5-9-16-23/h4-11,13-18,20-21,31H,2-3,12,19H2,1H3
InChIKey
UODSQTUPKMQQIG-UHFFFAOYSA-N
Compound name
3-pentylimino-N,5-diphenylphenazin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

432.23138 Da
Monoisotopic Mass

6.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 433.23866 208.5
[M+Na]+ 455.22060 214.7
[M-H]- 431.22410 217.1
[M+NH4]+ 450.26520 216.4
[M+K]+ 471.19454 205.1
[M+H-H2O]+ 415.22864 194.2
[M+HCOO]- 477.22958 228.5
[M+CH3COO]- 491.24523 216.0
[M+Na-2H]- 453.20605 215.5
[M]+ 432.23083 208.7
[M]- 432.23193 208.7
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.