CID 135765144

39844-58-1

Structural Information

Molecular Formula
C17H22N2O3
SMILES
CCC1(C(=O)C(CN(C1=O)/N=C/C2=CC=CC=C2O)C)CC
InChI
InChI=1S/C17H22N2O3/c1-4-17(5-2)15(21)12(3)11-19(16(17)22)18-10-13-8-6-7-9-14(13)20/h6-10,12,20H,4-5,11H2,1-3H3/b18-10+
InChIKey
LDYQLZSGRZVHOR-VCHYOVAHSA-N
Compound name
3,3-diethyl-1-[(E)-(2-hydroxyphenyl)methylideneamino]-5-methylpiperidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

302.16306 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 303.170336 169.6
[M+Na]+ 325.152278 177.3
[M-H]- 301.155784 175.1
[M+NH4]+ 320.196883 185.6
[M+K]+ 341.126218 173.6
[M+H-H2O]+ 285.160320 162.0
[M+HCOO]- 347.161261 189.6
[M+CH3COO]- 361.176911 208.3
[M+Na-2H]- 323.137726 171.6
[M]+ 302.16251142 169.8
[M]- 302.16360858 169.8
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.