CID 9574380

Nsc635420

Structural Information

Molecular Formula
C26H29N5O4
SMILES
CC\1C(=C(N=C(/C1=C(/C)\NNC(=O)C2=CC=CC=C2O)C)C)/C(=N/NC(=O)C3=CC=CC=C3O)/C
InChI
InChI=1S/C26H29N5O4/c1-14-23(17(4)28-30-25(34)19-10-6-8-12-21(19)32)15(2)27-16(3)24(14)18(5)29-31-26(35)20-11-7-9-13-22(20)33/h6-14,28,32-33H,1-5H3,(H,30,34)(H,31,35)/b23-17-,29-18+
InChIKey
MTVLBEWRQNKOLU-WJTNJEANSA-N
Compound name
2-hydroxy-N-[(E)-1-[(5Z)-5-[1-[2-(2-hydroxybenzoyl)hydrazinyl]ethylidene]-2,4,6-trimethyl-4H-pyridin-3-yl]ethylideneamino]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

475.22195 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 476.22923 217.6
[M+Na]+ 498.21117 220.0
[M-H]- 474.21467 224.7
[M+NH4]+ 493.25577 221.8
[M+K]+ 514.18511 216.2
[M+H-H2O]+ 458.21921 206.6
[M+HCOO]- 520.22015 236.3
[M+CH3COO]- 534.23580 249.9
[M+Na-2H]- 496.19662 214.3
[M]+ 475.22140 215.3
[M]- 475.22250 215.3
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.