CID 136806657

N-(2-(2-(2-hydroxy-5-methoxybenzylidene)hydrazino)-2-oxoethyl)-4-methylbenzamide

Structural Information

Molecular Formula
C18H19N3O4
SMILES
CC1=CC=C(C=C1)C(=O)NCC(=O)NN=CC2=C(C=CC(=C2)OC)O
InChI
InChI=1S/C18H19N3O4/c1-12-3-5-13(6-4-12)18(24)19-11-17(23)21-20-10-14-9-15(25-2)7-8-16(14)22/h3-10,22H,11H2,1-2H3,(H,19,24)(H,21,23)
InChIKey
VUPDPEHAMUDBJK-UHFFFAOYSA-N
Compound name
N-[2-[2-[(2-hydroxy-5-methoxyphenyl)methylidene]hydrazinyl]-2-oxoethyl]-4-methylbenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

341.13754 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 342.14482 179.5
[M+Na]+ 364.12676 184.4
[M-H]- 340.13026 186.2
[M+NH4]+ 359.17136 191.7
[M+K]+ 380.10070 181.6
[M+H-H2O]+ 324.13480 170.2
[M+HCOO]- 386.13574 204.9
[M+CH3COO]- 400.15139 218.8
[M+Na-2H]- 362.11221 182.2
[M]+ 341.13699 181.0
[M]- 341.13809 181.0
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.