CID 121503

2-(p-iodophenyl)-n-methylsuccinimide

Structural Information

Molecular Formula
C11H10INO2
SMILES
CN1C(=O)CC(C1=O)C2=CC=C(C=C2)I
InChI
InChI=1S/C11H10INO2/c1-13-10(14)6-9(11(13)15)7-2-4-8(12)5-3-7/h2-5,9H,6H2,1H3
InChIKey
IWAQFYJSHQVMSQ-UHFFFAOYSA-N
Compound name
3-(4-iodophenyl)-1-methylpyrrolidine-2,5-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

314.97562 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 315.98290 147.2
[M+Na]+ 337.96484 149.8
[M-H]- 313.96834 146.1
[M+NH4]+ 333.00944 162.1
[M+K]+ 353.93878 152.6
[M+H-H2O]+ 297.97288 137.2
[M+HCOO]- 359.97382 164.8
[M+CH3COO]- 373.98947 194.3
[M+Na-2H]- 335.95029 137.8
[M]+ 314.97507 144.3
[M]- 314.97617 144.3
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.