CID 6899041

N'-(4-butoxybenzylidene)-2-(2-isopropyl-5-methylphenoxy)acetohydrazide

Structural Information

Molecular Formula
C23H30N2O3
SMILES
CCCCOC1=CC=C(C=C1)/C=N/NC(=O)COC2=C(C=CC(=C2)C)C(C)C
InChI
InChI=1S/C23H30N2O3/c1-5-6-13-27-20-10-8-19(9-11-20)15-24-25-23(26)16-28-22-14-18(4)7-12-21(22)17(2)3/h7-12,14-15,17H,5-6,13,16H2,1-4H3,(H,25,26)/b24-15+
InChIKey
UVKBLZIUFWNCNQ-BUVRLJJBSA-N
Compound name
N-[(E)-(4-butoxyphenyl)methylideneamino]-2-(5-methyl-2-propan-2-ylphenoxy)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

382.22565 Da
Monoisotopic Mass

5.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 383.232926 196.9
[M+Na]+ 405.214868 200.7
[M-H]- 381.218374 204.0
[M+NH4]+ 400.259473 208.6
[M+K]+ 421.188808 197.4
[M+H-H2O]+ 365.222910 186.9
[M+HCOO]- 427.223851 220.6
[M+CH3COO]- 441.239501 229.8
[M+Na-2H]- 403.200316 196.7
[M]+ 382.22510142 202.1
[M]- 382.22619858 202.1
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.