CID 45054910

4-(2-(2,4-dihydroxybenzoyl)carbohydrazonoyl)-2-methoxyphenyl 4-methylbenzoate

Structural Information

Molecular Formula
C23H20N2O6
SMILES
CC1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2)/C=N/NC(=O)C3=C(C=C(C=C3)O)O)OC
InChI
InChI=1S/C23H20N2O6/c1-14-3-6-16(7-4-14)23(29)31-20-10-5-15(11-21(20)30-2)13-24-25-22(28)18-9-8-17(26)12-19(18)27/h3-13,26-27H,1-2H3,(H,25,28)/b24-13+
InChIKey
GNYKRXVLEJPWLG-ZMOGYAJESA-N
Compound name
[4-[(E)-[(2,4-dihydroxybenzoyl)hydrazinylidene]methyl]-2-methoxyphenyl] 4-methylbenzoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

420.13214 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 421.13942 200.5
[M+Na]+ 443.12136 212.7
[M+NH4]+ 438.16596 204.8
[M+K]+ 459.09530 207.0
[M-H]- 419.12486 205.3
[M+Na-2H]- 441.10681 207.8
[M]+ 420.13159 203.2
[M]- 420.13269 203.2
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.