CID 342415

57270-61-8

Structural Information

Molecular Formula
C24H30N4O5
SMILES
CCN(CC)C(=O)C1=CC(=O)C(=C2C1=NC3=C(O2)C(=C(C(=C3C(=O)N(CC)CC)N)O)C)C
InChI
InChI=1S/C24H30N4O5/c1-7-27(8-2)23(31)14-11-15(29)12(5)21-18(14)26-19-16(24(32)28(9-3)10-4)17(25)20(30)13(6)22(19)33-21/h11,30H,7-10,25H2,1-6H3
InChIKey
LOQXKYAWUVNORV-UHFFFAOYSA-N
Compound name
2-amino-1-N,1-N,9-N,9-N-tetraethyl-3-hydroxy-4,6-dimethyl-7-oxophenoxazine-1,9-dicarboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

454.22162 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 455.22890 215.8
[M+Na]+ 477.21084 223.0
[M-H]- 453.21434 221.9
[M+NH4]+ 472.25544 224.1
[M+K]+ 493.18478 222.5
[M+H-H2O]+ 437.21888 206.2
[M+HCOO]- 499.21982 233.2
[M+CH3COO]- 513.23547 252.8
[M+Na-2H]- 475.19629 213.8
[M]+ 454.22107 223.6
[M]- 454.22217 223.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.