CID 142464733

2761399-93-1

Structural Information

Molecular Formula
C19H22N4O5
SMILES
C1CC(=O)NC(=O)C1N2C(=O)C3=C(C2=O)C(=CC=C3)NC(=O)CCCCCN
InChI
InChI=1S/C19H22N4O5/c20-10-3-1-2-7-14(24)21-12-6-4-5-11-16(12)19(28)23(18(11)27)13-8-9-15(25)22-17(13)26/h4-6,13H,1-3,7-10,20H2,(H,21,24)(H,22,25,26)
InChIKey
WCPDDXPKCNDUMJ-UHFFFAOYSA-N
Compound name
6-amino-N-[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]hexanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

386.15903 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 387.16631 189.5
[M+Na]+ 409.14825 194.5
[M-H]- 385.15175 192.2
[M+NH4]+ 404.19285 199.4
[M+K]+ 425.12219 189.4
[M+H-H2O]+ 369.15629 180.9
[M+HCOO]- 431.15723 204.9
[M+CH3COO]- 445.17288 223.9
[M+Na-2H]- 407.13370 186.7
[M]+ 386.15848 186.4
[M]- 386.15958 186.4
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