CID 170090

38656-58-5

Structural Information

Molecular Formula
C18H20N3O3
SMILES
CCOC1=CC(=C(C=C1NC(=O)C2=CC=C(C=C2)C)OCC)[N+]#N
InChI
InChI=1S/C18H19N3O3/c1-4-23-16-11-15(21-19)17(24-5-2)10-14(16)20-18(22)13-8-6-12(3)7-9-13/h6-11H,4-5H2,1-3H3/p+1
InChIKey
FYNXTVAKTNQLFP-UHFFFAOYSA-O
Compound name
2,5-diethoxy-4-[(4-methylbenzoyl)amino]benzenediazonium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

326.15045 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 327.15773 177.2
[M+Na]+ 349.13967 190.8
[M+NH4]+ 344.18427 181.5
[M+K]+ 365.11361 181.3
[M-H]- 325.14317 175.9
[M+Na-2H]- 347.12512 182.5
[M]+ 326.14990 178.2
[M]- 326.15100 178.2
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

patents stripe