CID 473669

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

Structural Information

Molecular Formula
C28H26N4
SMILES
CCC(C)N=C1C=C2C(=NC3=CC=CC=C3N2C4=CC=CC=C4)C=C1NC5=CC=CC=C5
InChI
InChI=1S/C28H26N4/c1-3-20(2)29-25-19-28-26(18-24(25)30-21-12-6-4-7-13-21)31-23-16-10-11-17-27(23)32(28)22-14-8-5-9-15-22/h4-20,30H,3H2,1-2H3
InChIKey
BMYIAWQVAFAJOK-UHFFFAOYSA-N
Compound name
3-butan-2-ylimino-N,5-diphenylphenazin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

418.21576 Da
Monoisotopic Mass

6.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 419.22304 204.4
[M+Na]+ 441.20498 210.7
[M-H]- 417.20848 213.4
[M+NH4]+ 436.24958 212.9
[M+K]+ 457.17892 202.0
[M+H-H2O]+ 401.21302 190.7
[M+HCOO]- 463.21396 223.9
[M+CH3COO]- 477.22961 212.3
[M+Na-2H]- 439.19043 210.9
[M]+ 418.21521 203.9
[M]- 418.21631 203.9
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.