CID 9578781

[(e)-[benzofuran-2-yl-(4-methoxyphenyl)methylene]amino] acetate

Structural Information

Molecular Formula
C18H15NO4
SMILES
CC(=O)O/N=C(\C1=CC=C(C=C1)OC)/C2=CC3=CC=CC=C3O2
InChI
InChI=1S/C18H15NO4/c1-12(20)23-19-18(13-7-9-15(21-2)10-8-13)17-11-14-5-3-4-6-16(14)22-17/h3-11H,1-2H3/b19-18+
InChIKey
ZSWXCHLFZDGOOF-VHEBQXMUSA-N
Compound name
[(E)-[1-benzofuran-2-yl-(4-methoxyphenyl)methylidene]amino] acetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

309.1001 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 310.10738 170.4
[M+Na]+ 332.08932 178.8
[M-H]- 308.09282 180.8
[M+NH4]+ 327.13392 186.8
[M+K]+ 348.06326 177.4
[M+H-H2O]+ 292.09736 162.6
[M+HCOO]- 354.09830 196.2
[M+CH3COO]- 368.11395 208.1
[M+Na-2H]- 330.07477 175.6
[M]+ 309.09955 177.3
[M]- 309.10065 177.3
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.