CID 6444884

Brn 1662168

Structural Information

Molecular Formula
C16H16N4O4
SMILES
CC(=O)NC1=CC=C(C=C1)C(=O)N/C(=C\C2=CC=CO2)/C(=O)NN
InChI
InChI=1S/C16H16N4O4/c1-10(21)18-12-6-4-11(5-7-12)15(22)19-14(16(23)20-17)9-13-3-2-8-24-13/h2-9H,17H2,1H3,(H,18,21)(H,19,22)(H,20,23)/b14-9-
InChIKey
ZXNHSPWLUIPVEX-ZROIWOOFSA-N
Compound name
4-acetamido-N-[(Z)-1-(furan-2-yl)-3-hydrazinyl-3-oxoprop-1-en-2-yl]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

328.11716 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 329.12444 178.2
[M+Na]+ 351.10638 180.9
[M-H]- 327.10988 185.1
[M+NH4]+ 346.15098 190.1
[M+K]+ 367.08032 179.9
[M+H-H2O]+ 311.11442 169.3
[M+HCOO]- 373.11536 202.7
[M+CH3COO]- 387.13101 215.8
[M+Na-2H]- 349.09183 178.9
[M]+ 328.11661 175.9
[M]- 328.11771 175.9
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.