CID 202417

Morpholino-thalidomide

Structural Information

Molecular Formula
C18H19N3O5
SMILES
C1CC(=O)N(C(=O)C1N2C(=O)C3=CC=CC=C3C2=O)CN4CCOCC4
InChI
InChI=1S/C18H19N3O5/c22-15-6-5-14(18(25)20(15)11-19-7-9-26-10-8-19)21-16(23)12-3-1-2-4-13(12)17(21)24/h1-4,14H,5-11H2
InChIKey
IMFASZSXAQHCHV-UHFFFAOYSA-N
Compound name
2-[1-(morpholin-4-ylmethyl)-2,6-dioxopiperidin-3-yl]isoindole-1,3-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

357.13248 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 358.13976 183.9
[M+Na]+ 380.12170 190.1
[M-H]- 356.12520 190.3
[M+NH4]+ 375.16630 193.2
[M+K]+ 396.09564 186.5
[M+H-H2O]+ 340.12974 173.5
[M+HCOO]- 402.13068 195.0
[M+CH3COO]- 416.14633 192.4
[M+Na-2H]- 378.10715 181.5
[M]+ 357.13193 180.0
[M]- 357.13303 180.0
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