CID 2787226

2-(1,3-dioxo-1,3-dihydro-isoindol-2-yl)-n-(2-methoxy-phenyl)-propionamide

Structural Information

Molecular Formula
C18H16N2O4
SMILES
CC(C(=O)NC1=CC=CC=C1OC)N2C(=O)C3=CC=CC=C3C2=O
InChI
InChI=1S/C18H16N2O4/c1-11(16(21)19-14-9-5-6-10-15(14)24-2)20-17(22)12-7-3-4-8-13(12)18(20)23/h3-11H,1-2H3,(H,19,21)
InChIKey
XJWGCRYYCNWWIT-UHFFFAOYSA-N
Compound name
2-(1,3-dioxoisoindol-2-yl)-N-(2-methoxyphenyl)propanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

0
Patents

324.111 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 325.11828 173.5
[M+Na]+ 347.10022 181.1
[M-H]- 323.10372 180.3
[M+NH4]+ 342.14482 188.6
[M+K]+ 363.07416 177.6
[M+H-H2O]+ 307.10826 165.4
[M+HCOO]- 369.10920 194.6
[M+CH3COO]- 383.12485 211.3
[M+Na-2H]- 345.08567 174.6
[M]+ 324.11045 175.8
[M]- 324.11155 175.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.