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]+ 365.18596 188.8
[M+Na]+ 387.16790 195.3
[M-H]- 363.17140 195.3
[M+NH4]+ 382.21250 202.5
[M+K]+ 403.14184 191.0
[M+H-H2O]+ 347.17594 180.7
[M+HCOO]- 409.17688 207.3
[M+CH3COO]- 423.19253 223.2
[M+Na-2H]- 385.15335 185.8
[M]+ 364.17813 190.8
[M]- 364.17923 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.