CID 3066588

3-(3-bromophenyl)-1-(6-methyl-2-pyridinyl)succinimide

Structural Information

Molecular Formula
C16H13BrN2O2
SMILES
CC1=NC(=CC=C1)N2C(=O)CC(C2=O)C3=CC(=CC=C3)Br
InChI
InChI=1S/C16H13BrN2O2/c1-10-4-2-7-14(18-10)19-15(20)9-13(16(19)21)11-5-3-6-12(17)8-11/h2-8,13H,9H2,1H3
InChIKey
YOTBPVVWDMBTGQ-UHFFFAOYSA-N
Compound name
3-(3-bromophenyl)-1-(6-methylpyridin-2-yl)pyrrolidine-2,5-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

344.01605 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 345.02333 170.5
[M+Na]+ 367.00527 183.0
[M-H]- 343.00877 180.8
[M+NH4]+ 362.04987 187.1
[M+K]+ 382.97921 170.7
[M+H-H2O]+ 327.01331 168.5
[M+HCOO]- 389.01425 189.4
[M+CH3COO]- 403.02990 184.2
[M+Na-2H]- 364.99072 172.7
[M]+ 344.01550 188.8
[M]- 344.01660 188.8
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.