CID 5747430

149990-79-4

Structural Information

Molecular Formula
C24H20N2O5
SMILES
C1=CC=C(C=C1)/C(=C/C(=O)C(=O)NNC(=O)C(C2=CC=CC=C2)(C3=CC=CC=C3)O)/O
InChI
InChI=1S/C24H20N2O5/c27-20(17-10-4-1-5-11-17)16-21(28)22(29)25-26-23(30)24(31,18-12-6-2-7-13-18)19-14-8-3-9-15-19/h1-16,27,31H,(H,25,29)(H,26,30)/b20-16-
InChIKey
COFLNRDIMWAUBQ-SILNSSARSA-N
Compound name
(Z)-4-hydroxy-N'-(2-hydroxy-2,2-diphenylacetyl)-2-oxo-4-phenylbut-3-enehydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

416.1372 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 417.144476 196.1
[M+Na]+ 439.126418 196.6
[M-H]- 415.129924 201.9
[M+NH4]+ 434.171023 202.3
[M+K]+ 455.100358 192.7
[M+H-H2O]+ 399.134460 186.5
[M+HCOO]- 461.135401 213.5
[M+CH3COO]- 475.151051 222.4
[M+Na-2H]- 437.111866 198.4
[M]+ 416.13665142 191.9
[M]- 416.13774858 191.9
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

patents stripe