CID 9687764

N'-(4-((4-cl-benzyl)oxy)3-ethoxybenzylidene)2-(4-isopropylphenoxy)acetohydrazide

Structural Information

Molecular Formula
C27H29ClN2O4
SMILES
CCOC1=C(C=CC(=C1)/C=N/NC(=O)COC2=CC=C(C=C2)C(C)C)OCC3=CC=C(C=C3)Cl
InChI
InChI=1S/C27H29ClN2O4/c1-4-32-26-15-21(7-14-25(26)34-17-20-5-10-23(28)11-6-20)16-29-30-27(31)18-33-24-12-8-22(9-13-24)19(2)3/h5-16,19H,4,17-18H2,1-3H3,(H,30,31)/b29-16+
InChIKey
ORRYDWXBCYDLSK-MUFRIFMGSA-N
Compound name
N-[(E)-[4-[(4-chlorophenyl)methoxy]-3-ethoxyphenyl]methylideneamino]-2-(4-propan-2-ylphenoxy)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

480.18158 Da
Monoisotopic Mass

6.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 481.18886 219.2
[M+Na]+ 503.17080 233.1
[M+NH4]+ 498.21540 225.2
[M+K]+ 519.14474 223.6
[M-H]- 479.17430 226.0
[M+Na-2H]- 501.15625 227.8
[M]+ 480.18103 223.4
[M]- 480.18213 223.4
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.