CID 45055098

N-(2-(2-(3-hydroxybenzylidene)hydrazino)-2-oxoethyl)-4-propoxybenzamide

Structural Information

Molecular Formula
C19H21N3O4
SMILES
CCCOC1=CC=C(C=C1)C(=O)NCC(=O)N/N=C/C2=CC(=CC=C2)O
InChI
InChI=1S/C19H21N3O4/c1-2-10-26-17-8-6-15(7-9-17)19(25)20-13-18(24)22-21-12-14-4-3-5-16(23)11-14/h3-9,11-12,23H,2,10,13H2,1H3,(H,20,25)(H,22,24)/b21-12+
InChIKey
NIUZICDERBVSFX-CIAFOILYSA-N
Compound name
N-[2-[(2E)-2-[(3-hydroxyphenyl)methylidene]hydrazinyl]-2-oxoethyl]-4-propoxybenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

355.1532 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 356.16048 183.4
[M+Na]+ 378.14242 186.9
[M-H]- 354.14592 189.5
[M+NH4]+ 373.18702 194.7
[M+K]+ 394.11636 183.9
[M+H-H2O]+ 338.15046 173.7
[M+HCOO]- 400.15140 208.5
[M+CH3COO]- 414.16705 220.5
[M+Na-2H]- 376.12787 186.4
[M]+ 355.15265 184.8
[M]- 355.15375 184.8
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.