CID 9620695

2-(2-(3-bromobenzylidene)hydrazino)-n-(4-methylphenyl)-2-oxoacetamide

Structural Information

Molecular Formula
C16H14BrN3O2
SMILES
CC1=CC=C(C=C1)NC(=O)C(=O)N/N=C/C2=CC(=CC=C2)Br
InChI
InChI=1S/C16H14BrN3O2/c1-11-5-7-14(8-6-11)19-15(21)16(22)20-18-10-12-3-2-4-13(17)9-12/h2-10H,1H3,(H,19,21)(H,20,22)/b18-10+
InChIKey
HDUVWRIDLLHXNG-VCHYOVAHSA-N
Compound name
N'-[(E)-(3-bromophenyl)methylideneamino]-N-(4-methylphenyl)oxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

359.02695 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 360.03423 172.3
[M+Na]+ 382.01617 174.3
[M+NH4]+ 377.06077 175.5
[M+K]+ 397.99011 173.8
[M-H]- 358.01967 175.3
[M+Na-2H]- 380.00162 176.9
[M]+ 359.02640 172.0
[M]- 359.02750 172.0
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.