CID 9646892

108262-54-0

Structural Information

Molecular Formula
C23H23NO4
SMILES
CCOC(=O)C1=C(OC(=C1C2=CC=C(C=C2)OC)/N=C/C3=CC=C(C=C3)C)C
InChI
InChI=1S/C23H23NO4/c1-5-27-23(25)20-16(3)28-22(24-14-17-8-6-15(2)7-9-17)21(20)18-10-12-19(26-4)13-11-18/h6-14H,5H2,1-4H3/b24-14+
InChIKey
OJZVHJWRYZUOHP-ZVHZXABRSA-N
Compound name
ethyl 4-(4-methoxyphenyl)-2-methyl-5-[(E)-(4-methylphenyl)methylideneamino]furan-3-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

377.16272 Da
Monoisotopic Mass

5.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 378.17000 192.5
[M+Na]+ 400.15194 200.5
[M-H]- 376.15544 205.0
[M+NH4]+ 395.19654 205.5
[M+K]+ 416.12588 197.9
[M+H-H2O]+ 360.15998 183.4
[M+HCOO]- 422.16092 217.6
[M+CH3COO]- 436.17657 224.3
[M+Na-2H]- 398.13739 192.4
[M]+ 377.16217 200.0
[M]- 377.16327 200.0
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.