CID 9604765

[(e)-[(4-methoxyphenyl)-(3-methylbenzofuran-2-yl)methylene]amino] benzoate

Structural Information

Molecular Formula
C24H19NO4
SMILES
CC1=C(OC2=CC=CC=C12)/C(=N/OC(=O)C3=CC=CC=C3)/C4=CC=C(C=C4)OC
InChI
InChI=1S/C24H19NO4/c1-16-20-10-6-7-11-21(20)28-23(16)22(17-12-14-19(27-2)15-13-17)25-29-24(26)18-8-4-3-5-9-18/h3-15H,1-2H3/b25-22+
InChIKey
LDLYJBUOFQSNMN-YYDJUVGSSA-N
Compound name
[(E)-[(4-methoxyphenyl)-(3-methyl-1-benzofuran-2-yl)methylidene]amino] benzoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

385.1314 Da
Monoisotopic Mass

6.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 386.13868 193.0
[M+Na]+ 408.12062 200.6
[M-H]- 384.12412 206.1
[M+NH4]+ 403.16522 205.7
[M+K]+ 424.09456 197.8
[M+H-H2O]+ 368.12866 183.4
[M+HCOO]- 430.12960 217.7
[M+CH3COO]- 444.14525 204.5
[M+Na-2H]- 406.10607 196.2
[M]+ 385.13085 199.3
[M]- 385.13195 199.3
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.