CID 2813239

Maybridge3_002641

Structural Information

Molecular Formula
C14H16N2O3
SMILES
C1CC(=O)N(C1=O)C2=CC=CC=C2N3CCOCC3
InChI
InChI=1S/C14H16N2O3/c17-13-5-6-14(18)16(13)12-4-2-1-3-11(12)15-7-9-19-10-8-15/h1-4H,5-10H2
InChIKey
TUZYNWCYROEWKP-UHFFFAOYSA-N
Compound name
1-(2-morpholin-4-ylphenyl)pyrrolidine-2,5-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

0
Patents

260.1161 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 261.123376 158.7
[M+Na]+ 283.105318 164.6
[M-H]- 259.108824 165.7
[M+NH4]+ 278.149923 172.5
[M+K]+ 299.079258 162.4
[M+H-H2O]+ 243.113360 149.6
[M+HCOO]- 305.114301 175.4
[M+CH3COO]- 319.129951 169.7
[M+Na-2H]- 281.090766 159.8
[M]+ 260.11555142 154.4
[M]- 260.11664858 154.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.