CID 9639105

N-(2-(2-(4-methylbenzylidene)hydrazino)-2-oxoethyl)-4-propoxybenzamide

Structural Information

Molecular Formula
C20H23N3O3
SMILES
CCCOC1=CC=C(C=C1)C(=O)NCC(=O)N/N=C/C2=CC=C(C=C2)C
InChI
InChI=1S/C20H23N3O3/c1-3-12-26-18-10-8-17(9-11-18)20(25)21-14-19(24)23-22-13-16-6-4-15(2)5-7-16/h4-11,13H,3,12,14H2,1-2H3,(H,21,25)(H,23,24)/b22-13+
InChIKey
GVYXADQNHIRDFV-LPYMAVHISA-N
Compound name
N-[2-[(2E)-2-[(4-methylphenyl)methylidene]hydrazinyl]-2-oxoethyl]-4-propoxybenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

353.17395 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 354.18123 185.6
[M+Na]+ 376.16317 189.4
[M-H]- 352.16667 193.0
[M+NH4]+ 371.20777 197.9
[M+K]+ 392.13711 186.2
[M+H-H2O]+ 336.17121 175.7
[M+HCOO]- 398.17215 211.7
[M+CH3COO]- 412.18780 223.5
[M+Na-2H]- 374.14862 188.3
[M]+ 353.17340 187.9
[M]- 353.17450 187.9
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.