CID 3022147

2-(3,5-dibromophenyl)-n-(morpholinomethyl)succinimide

Structural Information

Molecular Formula
C15H16Br2N2O3
SMILES
C1COCCN1CN2C(=O)CC(C2=O)C3=CC(=CC(=C3)Br)Br
InChI
InChI=1S/C15H16Br2N2O3/c16-11-5-10(6-12(17)7-11)13-8-14(20)19(15(13)21)9-18-1-3-22-4-2-18/h5-7,13H,1-4,8-9H2
InChIKey
UVXSFCUFCMUSHV-UHFFFAOYSA-N
Compound name
3-(3,5-dibromophenyl)-1-(morpholin-4-ylmethyl)pyrrolidine-2,5-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

429.95276 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 430.96004 173.4
[M+Na]+ 452.94198 182.1
[M-H]- 428.94548 182.8
[M+NH4]+ 447.98658 186.5
[M+K]+ 468.91592 168.4
[M+H-H2O]+ 412.95002 180.5
[M+HCOO]- 474.95096 183.7
[M+CH3COO]- 488.96661 220.3
[M+Na-2H]- 450.92743 174.5
[M]+ 429.95221 205.2
[M]- 429.95331 205.2
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.