CID 473717

(3z)-5-(2-diethylaminoethyl)-n-phenyl-3-phenylimino-phenazin-2-amine

Structural Information

Molecular Formula
C30H31N5
SMILES
CCN(CC)CCN1C2=CC=CC=C2N=C3C1=CC(=NC4=CC=CC=C4)C(=C3)NC5=CC=CC=C5
InChI
InChI=1S/C30H31N5/c1-3-34(4-2)19-20-35-29-18-12-11-17-25(29)33-28-21-26(31-23-13-7-5-8-14-23)27(22-30(28)35)32-24-15-9-6-10-16-24/h5-18,21-22,31H,3-4,19-20H2,1-2H3
InChIKey
AZETYGWUMCFPEZ-UHFFFAOYSA-N
Compound name
5-[2-(diethylamino)ethyl]-N-phenyl-3-phenyliminophenazin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

461.25793 Da
Monoisotopic Mass

6.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 462.26521 215.1
[M+Na]+ 484.24715 219.9
[M-H]- 460.25065 224.7
[M+NH4]+ 479.29175 222.0
[M+K]+ 500.22109 211.8
[M+H-H2O]+ 444.25519 200.3
[M+HCOO]- 506.25613 236.2
[M+CH3COO]- 520.27178 222.2
[M+Na-2H]- 482.23260 221.8
[M]+ 461.25738 216.3
[M]- 461.25848 216.3
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

patents stripe