CID 134348132

Lenalidomide-i

Structural Information

Molecular Formula
C13H11IN2O3
SMILES
C1CC(=O)NC(=O)C1N2CC3=C(C2=O)C=CC=C3I
InChI
InChI=1S/C13H11IN2O3/c14-9-3-1-2-7-8(9)6-16(13(7)19)10-4-5-11(17)15-12(10)18/h1-3,10H,4-6H2,(H,15,17,18)
InChIKey
BKIUJJLYXXEGFT-UHFFFAOYSA-N
Compound name
3-(7-iodo-3-oxo-1H-isoindol-2-yl)piperidine-2,6-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

109
Patents

369.98145 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 370.98873 169.2
[M+Na]+ 392.97067 172.9
[M+NH4]+ 388.01527 171.5
[M+K]+ 408.94461 172.2
[M-H]- 368.97417 164.2
[M+Na-2H]- 390.95612 159.6
[M]+ 369.98090 166.9
[M]- 369.98200 166.9
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

patents stripe