CID 6076839

N'-(4-(allyloxy)benzylidene)-3,4,5-trimethoxybenzohydrazide

Structural Information

Molecular Formula
C20H22N2O5
SMILES
COC1=CC(=CC(=C1OC)OC)C(=O)N/N=C/C2=CC=C(C=C2)OCC=C
InChI
InChI=1S/C20H22N2O5/c1-5-10-27-16-8-6-14(7-9-16)13-21-22-20(23)15-11-17(24-2)19(26-4)18(12-15)25-3/h5-9,11-13H,1,10H2,2-4H3,(H,22,23)/b21-13+
InChIKey
RCVKJFVAUJBGLU-FYJGNVAPSA-N
Compound name
3,4,5-trimethoxy-N-[(E)-(4-prop-2-enoxyphenyl)methylideneamino]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

370.15286 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 371.16014 186.8
[M+Na]+ 393.14208 193.1
[M-H]- 369.14558 194.9
[M+NH4]+ 388.18668 199.1
[M+K]+ 409.11602 190.8
[M+H-H2O]+ 353.15012 177.0
[M+HCOO]- 415.15106 213.1
[M+CH3COO]- 429.16671 224.9
[M+Na-2H]- 391.12753 189.1
[M]+ 370.15231 194.1
[M]- 370.15341 194.1
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.