CID 6870888

N'-benzylidene-3,4,5-trimethoxybenzohydrazide

Structural Information

Molecular Formula
C17H18N2O4
SMILES
COC1=CC(=CC(=C1OC)OC)C(=O)N/N=C/C2=CC=CC=C2
InChI
InChI=1S/C17H18N2O4/c1-21-14-9-13(10-15(22-2)16(14)23-3)17(20)19-18-11-12-7-5-4-6-8-12/h4-11H,1-3H3,(H,19,20)/b18-11+
InChIKey
YYSPJNXAGUXEGN-WOJGMQOQSA-N
Compound name
N-[(E)-benzylideneamino]-3,4,5-trimethoxybenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

314.12665 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 315.13393 171.8
[M+Na]+ 337.11587 178.5
[M-H]- 313.11937 180.1
[M+NH4]+ 332.16047 186.4
[M+K]+ 353.08981 176.6
[M+H-H2O]+ 297.12391 162.7
[M+HCOO]- 359.12485 198.9
[M+CH3COO]- 373.14050 213.3
[M+Na-2H]- 335.10132 176.2
[M]+ 314.12610 177.0
[M]- 314.12720 177.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.