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]+ 356.160476 183.4
[M+Na]+ 378.142418 186.9
[M-H]- 354.145924 189.5
[M+NH4]+ 373.187023 194.7
[M+K]+ 394.116358 183.9
[M+H-H2O]+ 338.150460 173.7
[M+HCOO]- 400.151401 208.5
[M+CH3COO]- 414.167051 220.5
[M+Na-2H]- 376.127866 186.4
[M]+ 355.15265142 184.8
[M]- 355.15374858 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.