CID 73562186

2-(3,4-dimethylphenoxy)-n'-(4-((4-methylbenzyl)oxy)benzylidene)acetohydrazide

Structural Information

Molecular Formula
C25H26N2O3
SMILES
CC1=CC=C(C=C1)COC2=CC=C(C=C2)C=NNC(=O)COC3=CC(=C(C=C3)C)C
InChI
InChI=1S/C25H26N2O3/c1-18-4-7-22(8-5-18)16-29-23-12-9-21(10-13-23)15-26-27-25(28)17-30-24-11-6-19(2)20(3)14-24/h4-15H,16-17H2,1-3H3,(H,27,28)
InChIKey
MFNGLQHSBQEDEI-UHFFFAOYSA-N
Compound name
2-(3,4-dimethylphenoxy)-N-[[4-[(4-methylphenyl)methoxy]phenyl]methylideneamino]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

402.19434 Da
Monoisotopic Mass

5.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 403.201616 200.3
[M+Na]+ 425.183558 205.6
[M-H]- 401.187064 211.0
[M+NH4]+ 420.228163 210.9
[M+K]+ 441.157498 201.0
[M+H-H2O]+ 385.191600 189.1
[M+HCOO]- 447.192541 225.5
[M+CH3COO]- 461.208191 232.0
[M+Na-2H]- 423.169006 202.1
[M]+ 402.19379142 204.4
[M]- 402.19488858 204.4
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.