CID 9630534

3,4-dimethoxy-n-(2-(2-(4-methylbenzylidene)hydrazino)-2-oxoethyl)benzamide

Structural Information

Molecular Formula
C19H21N3O4
SMILES
CC1=CC=C(C=C1)/C=N/NC(=O)CNC(=O)C2=CC(=C(C=C2)OC)OC
InChI
InChI=1S/C19H21N3O4/c1-13-4-6-14(7-5-13)11-21-22-18(23)12-20-19(24)15-8-9-16(25-2)17(10-15)26-3/h4-11H,12H2,1-3H3,(H,20,24)(H,22,23)/b21-11+
InChIKey
ZCXWAOWECDTNBG-SRZZPIQSSA-N
Compound name
3,4-dimethoxy-N-[2-[(2E)-2-[(4-methylphenyl)methylidene]hydrazinyl]-2-oxoethyl]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

355.1532 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 356.16048 184.0
[M+Na]+ 378.14242 188.9
[M-H]- 354.14592 191.9
[M+NH4]+ 373.18702 196.4
[M+K]+ 394.11636 186.7
[M+H-H2O]+ 338.15046 174.2
[M+HCOO]- 400.15140 210.6
[M+CH3COO]- 414.16705 224.0
[M+Na-2H]- 376.12787 186.6
[M]+ 355.15265 187.7
[M]- 355.15375 187.7
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.