CID 135602186

Acetamide, n-[5-chloro-3-[[4-(diethylamino)-2-methylphenyl]imino]-4-methyl-6-oxo-1,4-cyclohexadien-1-yl]-

Structural Information

Molecular Formula
C20H24ClN3O2
SMILES
CCN(CC)C1=CC(=C(C=C1)N=C2C=C(C(=O)C(=C2C)Cl)NC(=O)C)C
InChI
InChI=1S/C20H24ClN3O2/c1-6-24(7-2)15-8-9-16(12(3)10-15)23-17-11-18(22-14(5)25)20(26)19(21)13(17)4/h8-11H,6-7H2,1-5H3,(H,22,25)
InChIKey
HYINZODUJDSJMX-UHFFFAOYSA-N
Compound name
N-[5-chloro-3-[4-(diethylamino)-2-methylphenyl]imino-4-methyl-6-oxocyclohexa-1,4-dien-1-yl]acetamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

81
Patents

373.1557 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 374.16298 191.8
[M+Na]+ 396.14492 199.6
[M-H]- 372.14842 201.5
[M+NH4]+ 391.18952 206.1
[M+K]+ 412.11886 195.2
[M+H-H2O]+ 356.15296 183.8
[M+HCOO]- 418.15390 213.1
[M+CH3COO]- 432.16955 233.3
[M+Na-2H]- 394.13037 190.4
[M]+ 373.15515 197.3
[M]- 373.15625 197.3
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

patents stripe