CID 135765146

39844-60-5

Structural Information

Molecular Formula
C18H24N2O4
SMILES
CCC1(C(=O)C(CN(C1=O)/N=C/C2=CC(=C(C=C2)O)OC)C)CC
InChI
InChI=1S/C18H24N2O4/c1-5-18(6-2)16(22)12(3)11-20(17(18)23)19-10-13-7-8-14(21)15(9-13)24-4/h7-10,12,21H,5-6,11H2,1-4H3/b19-10+
InChIKey
GNEFMSJFALPEMT-VXLYETTFSA-N
Compound name
3,3-diethyl-1-[(E)-(4-hydroxy-3-methoxyphenyl)methylideneamino]-5-methylpiperidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

332.1736 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 333.180876 176.2
[M+Na]+ 355.162818 184.1
[M-H]- 331.166324 181.8
[M+NH4]+ 350.207423 191.1
[M+K]+ 371.136758 181.0
[M+H-H2O]+ 315.170860 168.5
[M+HCOO]- 377.171801 195.9
[M+CH3COO]- 391.187451 214.9
[M+Na-2H]- 353.148266 177.2
[M]+ 332.17305142 178.6
[M]- 332.17414858 178.6
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.