CID 75624

1-(2-(ethyl(m-tolyl)amino)ethyl)pyrrolidine-2,5-dione

Structural Information

Molecular Formula
C15H20N2O2
SMILES
CCN(CCN1C(=O)CCC1=O)C2=CC=CC(=C2)C
InChI
InChI=1S/C15H20N2O2/c1-3-16(13-6-4-5-12(2)11-13)9-10-17-14(18)7-8-15(17)19/h4-6,11H,3,7-10H2,1-2H3
InChIKey
SNLLVPIXRHTWRC-UHFFFAOYSA-N
Compound name
1-[2-(N-ethyl-3-methylanilino)ethyl]pyrrolidine-2,5-dione
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

5
Patents

260.15247 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 261.15975 160.7
[M+Na]+ 283.14169 167.2
[M-H]- 259.14519 167.3
[M+NH4]+ 278.18629 178.4
[M+K]+ 299.11563 164.8
[M+H-H2O]+ 243.14973 152.7
[M+HCOO]- 305.15067 183.7
[M+CH3COO]- 319.16632 202.4
[M+Na-2H]- 281.12714 161.4
[M]+ 260.15192 161.7
[M]- 260.15302 161.7
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