CID 25147

10312-36-4

Structural Information

Molecular Formula
C16H20N2O3
SMILES
CCN(CC)C(=O)CCCN1C(=O)C2=CC=CC=C2C1=O
InChI
InChI=1S/C16H20N2O3/c1-3-17(4-2)14(19)10-7-11-18-15(20)12-8-5-6-9-13(12)16(18)21/h5-6,8-9H,3-4,7,10-11H2,1-2H3
InChIKey
NCCXKYUWIXTJAF-UHFFFAOYSA-N
Compound name
4-(1,3-dioxoisoindol-2-yl)-N,N-diethylbutanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

288.1474 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 289.15468 168.0
[M+Na]+ 311.13662 177.7
[M+NH4]+ 306.18122 174.2
[M+K]+ 327.11056 173.9
[M-H]- 287.14012 168.5
[M+Na-2H]- 309.12207 170.4
[M]+ 288.14685 169.1
[M]- 288.14795 169.1
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.