CID 9671789

2-(5-isopropyl-2-methylphenoxy)-n'-(4-methylbenzylidene)acetohydrazide

Structural Information

Molecular Formula
C20H24N2O2
SMILES
CC1=CC=C(C=C1)/C=N/NC(=O)COC2=C(C=CC(=C2)C(C)C)C
InChI
InChI=1S/C20H24N2O2/c1-14(2)18-10-7-16(4)19(11-18)24-13-20(23)22-21-12-17-8-5-15(3)6-9-17/h5-12,14H,13H2,1-4H3,(H,22,23)/b21-12+
InChIKey
YMHAWAQZQGZKIJ-CIAFOILYSA-N
Compound name
N-[(E)-(4-methylphenyl)methylideneamino]-2-(2-methyl-5-propan-2-ylphenoxy)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

324.18378 Da
Monoisotopic Mass

4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 325.191056 180.2
[M+Na]+ 347.172998 185.6
[M-H]- 323.176504 188.0
[M+NH4]+ 342.217603 194.5
[M+K]+ 363.146938 182.3
[M+H-H2O]+ 307.181040 171.1
[M+HCOO]- 369.181981 204.8
[M+CH3COO]- 383.197631 218.8
[M+Na-2H]- 345.158446 181.6
[M]+ 324.18323142 183.0
[M]- 324.18432858 183.0
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.