CID 75623

N-(2-(n-ethyl-m-toluidino)ethyl)phthalimide

Structural Information

Molecular Formula
C19H20N2O2
SMILES
CCN(CCN1C(=O)C2=CC=CC=C2C1=O)C3=CC=CC(=C3)C
InChI
InChI=1S/C19H20N2O2/c1-3-20(15-8-6-7-14(2)13-15)11-12-21-18(22)16-9-4-5-10-17(16)19(21)23/h4-10,13H,3,11-12H2,1-2H3
InChIKey
BMYMLHZMMRCSDA-UHFFFAOYSA-N
Compound name
2-[2-(N-ethyl-3-methylanilino)ethyl]isoindole-1,3-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

308.15247 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 309.159746 173.3
[M+Na]+ 331.141688 181.2
[M-H]- 307.145194 181.1
[M+NH4]+ 326.186293 190.1
[M+K]+ 347.115628 176.9
[M+H-H2O]+ 291.149730 164.7
[M+HCOO]- 353.150671 196.0
[M+CH3COO]- 367.166321 212.8
[M+Na-2H]- 329.127136 175.0
[M]+ 308.15192142 176.2
[M]- 308.15301858 176.2
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