CID 378943

Nsc662451

Structural Information

Molecular Formula
C24H19N3O4
SMILES
CC1=CC=CC=C1NC(=O)C2=CC3=C(C=CC(=C3)N=NC4=CC=C(C=C4)OC)OC2=O
InChI
InChI=1S/C24H19N3O4/c1-15-5-3-4-6-21(15)25-23(28)20-14-16-13-18(9-12-22(16)31-24(20)29)27-26-17-7-10-19(30-2)11-8-17/h3-14H,1-2H3,(H,25,28)
InChIKey
ZJVMYWTYUAFFOA-UHFFFAOYSA-N
Compound name
6-[(4-methoxyphenyl)diazenyl]-N-(2-methylphenyl)-2-oxochromene-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

413.13754 Da
Monoisotopic Mass

5.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 414.14482 200.1
[M+Na]+ 436.12676 207.8
[M-H]- 412.13026 214.3
[M+NH4]+ 431.17136 210.0
[M+K]+ 452.10070 205.1
[M+H-H2O]+ 396.13480 188.1
[M+HCOO]- 458.13574 226.9
[M+CH3COO]- 472.15139 237.7
[M+Na-2H]- 434.11221 206.3
[M]+ 413.13699 205.2
[M]- 413.13809 205.2
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.