CID 473711

(3z)-5-(4-chlorophenyl)-n-cyclohexyl-3-cyclohexylimino-phenazin-2-amine

Structural Information

Molecular Formula
C30H33ClN4
SMILES
C1CCC(CC1)NC2=CC3=NC4=CC=CC=C4N(C3=CC2=NC5CCCCC5)C6=CC=C(C=C6)Cl
InChI
InChI=1S/C30H33ClN4/c31-21-15-17-24(18-16-21)35-29-14-8-7-13-25(29)34-28-19-26(32-22-9-3-1-4-10-22)27(20-30(28)35)33-23-11-5-2-6-12-23/h7-8,13-20,22-23,32H,1-6,9-12H2
InChIKey
KYRPGTGHWFQJDN-UHFFFAOYSA-N
Compound name
5-(4-chlorophenyl)-N-cyclohexyl-3-cyclohexyliminophenazin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

484.23938 Da
Monoisotopic Mass

7.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 485.24666 218.0
[M+Na]+ 507.22860 220.5
[M-H]- 483.23210 227.0
[M+NH4]+ 502.27320 223.7
[M+K]+ 523.20254 210.5
[M+H-H2O]+ 467.23664 202.4
[M+HCOO]- 529.23758 225.8
[M+CH3COO]- 543.25323 222.5
[M+Na-2H]- 505.21405 219.2
[M]+ 484.23883 210.6
[M]- 484.23993 210.6
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.