CID 9636964

N-(2-(2-benzylidenehydrazino)-2-oxoethyl)-4-methoxybenzamide

Structural Information

Molecular Formula
C17H17N3O3
SMILES
COC1=CC=C(C=C1)C(=O)NCC(=O)N/N=C/C2=CC=CC=C2
InChI
InChI=1S/C17H17N3O3/c1-23-15-9-7-14(8-10-15)17(22)18-12-16(21)20-19-11-13-5-3-2-4-6-13/h2-11H,12H2,1H3,(H,18,22)(H,20,21)/b19-11+
InChIKey
KARMCIWVACCTOC-YBFXNURJSA-N
Compound name
N-[2-[(2E)-2-benzylidenehydrazinyl]-2-oxoethyl]-4-methoxybenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

311.12698 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 312.13426 173.8
[M+Na]+ 334.11620 184.1
[M+NH4]+ 329.16080 179.9
[M+K]+ 350.09014 177.7
[M-H]- 310.11970 178.3
[M+Na-2H]- 332.10165 181.6
[M]+ 311.12643 176.1
[M]- 311.12753 176.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.