CID 5941349

N-(4-ethylphenyl)-2-oxo-2-(2-(2-thienylmethylene)hydrazino)acetamide

Structural Information

Molecular Formula
C15H15N3O2S
SMILES
CCC1=CC=C(C=C1)NC(=O)C(=O)N/N=C/C2=CC=CS2
InChI
InChI=1S/C15H15N3O2S/c1-2-11-5-7-12(8-6-11)17-14(19)15(20)18-16-10-13-4-3-9-21-13/h3-10H,2H2,1H3,(H,17,19)(H,18,20)/b16-10+
InChIKey
YWLQPNDOBNOBNS-MHWRWJLKSA-N
Compound name
N-(4-ethylphenyl)-N'-[(E)-thiophen-2-ylmethylideneamino]oxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

301.0885 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 302.09578 170.7
[M+Na]+ 324.07772 179.2
[M+NH4]+ 319.12232 177.7
[M+K]+ 340.05166 173.0
[M-H]- 300.08122 174.9
[M+Na-2H]- 322.06317 177.1
[M]+ 301.08795 173.1
[M]- 301.08905 173.1
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.