CID 106008

67893-44-1

Structural Information

Molecular Formula
C20H24N4O5
SMILES
CCOC1=CC(=C(C=C1NC(=O)C2=CC=CC=C2)OCC)N=NN(C)CC(=O)O
InChI
InChI=1S/C20H24N4O5/c1-4-28-17-12-16(22-23-24(3)13-19(25)26)18(29-5-2)11-15(17)21-20(27)14-9-7-6-8-10-14/h6-12H,4-5,13H2,1-3H3,(H,21,27)(H,25,26)
InChIKey
ZUALJMVDIMHVIT-UHFFFAOYSA-N
Compound name
2-[[(4-benzamido-2,5-diethoxyphenyl)diazenyl]-methylamino]acetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

400.17468 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 401.18196 195.5
[M+Na]+ 423.16390 203.7
[M+NH4]+ 418.20850 199.5
[M+K]+ 439.13784 199.1
[M-H]- 399.16740 199.5
[M+Na-2H]- 421.14935 201.1
[M]+ 400.17413 197.2
[M]- 400.17523 197.2
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.