CID 473679

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

Structural Information

Molecular Formula
C32H32N4
SMILES
CC1CC(CC(C1)N=C2C=C3C(=NC4=CC=CC=C4N3C5=CC=CC=C5)C=C2NC6=CC=CC=C6)C
InChI
InChI=1S/C32H32N4/c1-22-17-23(2)19-25(18-22)34-29-21-32-30(20-28(29)33-24-11-5-3-6-12-24)35-27-15-9-10-16-31(27)36(32)26-13-7-4-8-14-26/h3-16,20-23,25,33H,17-19H2,1-2H3
InChIKey
YLDZGFWDUWLMNK-UHFFFAOYSA-N
Compound name
3-(3,5-dimethylcyclohexyl)imino-N,5-diphenylphenazin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

472.2627 Da
Monoisotopic Mass

7.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 473.26998 219.7
[M+Na]+ 495.25192 224.3
[M-H]- 471.25542 230.4
[M+NH4]+ 490.29652 225.3
[M+K]+ 511.22586 214.5
[M+H-H2O]+ 455.25996 203.8
[M+HCOO]- 517.26090 235.2
[M+CH3COO]- 531.27655 225.5
[M+Na-2H]- 493.23737 222.6
[M]+ 472.26215 214.6
[M]- 472.26325 214.6
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.