CID 978553

N-(2,6-diisopropylphenyl)-2-(1,3-dioxo-1,3-dihydro-2h-isoindol-2-yl)acetamide

Structural Information

Molecular Formula
C22H24N2O3
SMILES
CC(C)C1=C(C(=CC=C1)C(C)C)NC(=O)CN2C(=O)C3=CC=CC=C3C2=O
InChI
InChI=1S/C22H24N2O3/c1-13(2)15-10-7-11-16(14(3)4)20(15)23-19(25)12-24-21(26)17-8-5-6-9-18(17)22(24)27/h5-11,13-14H,12H2,1-4H3,(H,23,25)
InChIKey
MFLBZPZZCMFGGI-UHFFFAOYSA-N
Compound name
2-(1,3-dioxoisoindol-2-yl)-N-[2,6-di(propan-2-yl)phenyl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

364.17868 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 365.185956 188.8
[M+Na]+ 387.167898 195.3
[M-H]- 363.171404 195.3
[M+NH4]+ 382.212503 202.5
[M+K]+ 403.141838 191.0
[M+H-H2O]+ 347.175940 180.7
[M+HCOO]- 409.176881 207.3
[M+CH3COO]- 423.192531 223.2
[M+Na-2H]- 385.153346 185.8
[M]+ 364.17813142 190.8
[M]- 364.17922858 190.8
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.