CID 61326986

4-(3-aminophenyl)morpholine-3,5-dione

Structural Information

Molecular Formula
C10H10N2O3
SMILES
C1C(=O)N(C(=O)CO1)C2=CC=CC(=C2)N
InChI
InChI=1S/C10H10N2O3/c11-7-2-1-3-8(4-7)12-9(13)5-15-6-10(12)14/h1-4H,5-6,11H2
InChIKey
VKPMXFLZVHGEOF-UHFFFAOYSA-N
Compound name
4-(3-aminophenyl)morpholine-3,5-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

206.06914 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 207.07642 142.9
[M+Na]+ 229.05836 150.7
[M-H]- 205.06186 148.7
[M+NH4]+ 224.10296 158.6
[M+K]+ 245.03230 149.2
[M+H-H2O]+ 189.06640 135.2
[M+HCOO]- 251.06734 163.6
[M+CH3COO]- 265.08299 186.1
[M+Na-2H]- 227.04381 148.2
[M]+ 206.06859 139.9
[M]- 206.06969 139.9
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.