CID 135765146

Brn 1499613

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]+ 333.18088 176.2
[M+Na]+ 355.16282 184.1
[M-H]- 331.16632 181.8
[M+NH4]+ 350.20742 191.1
[M+K]+ 371.13676 181.0
[M+H-H2O]+ 315.17086 168.5
[M+HCOO]- 377.17180 195.9
[M+CH3COO]- 391.18745 214.9
[M+Na-2H]- 353.14827 177.2
[M]+ 332.17305 178.6
[M]- 332.17415 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.