CID 473719

Schembl20840218

Structural Information

Molecular Formula
C29H28N4O2
SMILES
CC(C)N=C1C=C2C(=NC3=CC=CC=C3N2C4=CC=C(C=C4)OC)C=C1NC5=CC=C(C=C5)OC
InChI
InChI=1S/C29H28N4O2/c1-19(2)30-26-18-29-27(17-25(26)31-20-9-13-22(34-3)14-10-20)32-24-7-5-6-8-28(24)33(29)21-11-15-23(35-4)16-12-21/h5-19,31H,1-4H3
InChIKey
XBTATZCJVKOKHI-UHFFFAOYSA-N
Compound name
N,5-bis(4-methoxyphenyl)-3-propan-2-yliminophenazin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

464.22122 Da
Monoisotopic Mass

5.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 465.22850 217.6
[M+Na]+ 487.21044 224.6
[M-H]- 463.21394 227.1
[M+NH4]+ 482.25504 224.4
[M+K]+ 503.18438 217.6
[M+H-H2O]+ 447.21848 203.4
[M+HCOO]- 509.21942 236.8
[M+CH3COO]- 523.23507 225.2
[M+Na-2H]- 485.19589 222.1
[M]+ 464.22067 220.8
[M]- 464.22177 220.8
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