CID 9624344

391883-71-9

Structural Information

Molecular Formula
C23H23N3O5
SMILES
COC1=CC(=CC(=C1OC)OC)/C=N/NC(=O)CNC(=O)C2=CC=CC3=CC=CC=C32
InChI
InChI=1S/C23H23N3O5/c1-29-19-11-15(12-20(30-2)22(19)31-3)13-25-26-21(27)14-24-23(28)18-10-6-8-16-7-4-5-9-17(16)18/h4-13H,14H2,1-3H3,(H,24,28)(H,26,27)/b25-13+
InChIKey
MVFWUIMZVSDUPS-DHRITJCHSA-N
Compound name
N-[2-oxo-2-[(2E)-2-[(3,4,5-trimethoxyphenyl)methylidene]hydrazinyl]ethyl]naphthalene-1-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

421.16376 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 422.17104 199.2
[M+Na]+ 444.15298 203.9
[M-H]- 420.15648 207.6
[M+NH4]+ 439.19758 209.5
[M+K]+ 460.12692 201.6
[M+H-H2O]+ 404.16102 188.5
[M+HCOO]- 466.16196 224.0
[M+CH3COO]- 480.17761 237.2
[M+Na-2H]- 442.13843 202.7
[M]+ 421.16321 204.7
[M]- 421.16431 204.7
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.