CID 6435179

N-phenethylglycine 2-(2-benzofuranylmethylene)hydrazide

Structural Information

Molecular Formula
C19H19N3O2
SMILES
C1=CC=C(C=C1)CCN/C(=C/C2=CC3=CC=CC=C3O2)/C(=O)NN
InChI
InChI=1S/C19H19N3O2/c20-22-19(23)17(21-11-10-14-6-2-1-3-7-14)13-16-12-15-8-4-5-9-18(15)24-16/h1-9,12-13,21H,10-11,20H2,(H,22,23)/b17-13+
InChIKey
KEJJHDKEDWWZEO-GHRIWEEISA-N
Compound name
(E)-3-(1-benzofuran-2-yl)-2-(2-phenylethylamino)prop-2-enehydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

321.14774 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 322.15502 175.4
[M+Na]+ 344.13696 180.4
[M-H]- 320.14046 183.1
[M+NH4]+ 339.18156 189.4
[M+K]+ 360.11090 176.4
[M+H-H2O]+ 304.14500 166.9
[M+HCOO]- 366.14594 200.4
[M+CH3COO]- 380.16159 213.1
[M+Na-2H]- 342.12241 180.4
[M]+ 321.14719 175.3
[M]- 321.14829 175.3
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.