CID 10154850

2-chloro-n-(2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindolin-4-yl)acetamide

Structural Information

Molecular Formula
C15H12ClN3O5
SMILES
C1CC(=O)NC(=O)C1N2C(=O)C3=C(C2=O)C(=CC=C3)NC(=O)CCl
InChI
InChI=1S/C15H12ClN3O5/c16-6-11(21)17-8-3-1-2-7-12(8)15(24)19(14(7)23)9-4-5-10(20)18-13(9)22/h1-3,9H,4-6H2,(H,17,21)(H,18,20,22)
InChIKey
SVSMQAPPCVNXQW-UHFFFAOYSA-N
Compound name
2-chloro-N-[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

43
Patents

349.04654 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 350.05382 175.7
[M+Na]+ 372.03576 184.3
[M-H]- 348.03926 179.6
[M+NH4]+ 367.08036 188.7
[M+K]+ 388.00970 178.5
[M+H-H2O]+ 332.04380 168.7
[M+HCOO]- 394.04474 187.5
[M+CH3COO]- 408.06039 210.4
[M+Na-2H]- 370.02121 174.5
[M]+ 349.04599 175.0
[M]- 349.04709 175.0
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

patents stripe