CID 9557599

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

Structural Information

Molecular Formula
C19H21ClN2O2
SMILES
CC1=CC(=C(C=C1)C(C)C)OCC(=O)N/N=C/C2=CC=C(C=C2)Cl
InChI
InChI=1S/C19H21ClN2O2/c1-13(2)17-9-4-14(3)10-18(17)24-12-19(23)22-21-11-15-5-7-16(20)8-6-15/h4-11,13H,12H2,1-3H3,(H,22,23)/b21-11+
InChIKey
WATYNMUFMYYDAE-SRZZPIQSSA-N
Compound name
N-[(E)-(4-chlorophenyl)methylideneamino]-2-(5-methyl-2-propan-2-ylphenoxy)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

344.12915 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 345.13643 182.9
[M+Na]+ 367.11837 189.6
[M-H]- 343.12187 190.7
[M+NH4]+ 362.16297 197.3
[M+K]+ 383.09231 184.6
[M+H-H2O]+ 327.12641 174.8
[M+HCOO]- 389.12735 203.4
[M+CH3COO]- 403.14300 219.4
[M+Na-2H]- 365.10382 184.3
[M]+ 344.12860 187.7
[M]- 344.12970 187.7
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.