CID 99858

Hexahydrophthalimide glutarimide

Structural Information

Molecular Formula
C13H16N2O4
SMILES
C1CCC2C(C1)C(=O)N(C2=O)C3CCC(=O)NC3=O
InChI
InChI=1S/C13H16N2O4/c16-10-6-5-9(11(17)14-10)15-12(18)7-3-1-2-4-8(7)13(15)19/h7-9H,1-6H2,(H,14,16,17)
InChIKey
IWKLKPPKVNKYPD-UHFFFAOYSA-N
Compound name
2-(2,6-dioxopiperidin-3-yl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

33
Patents

264.111 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 265.11828 160.1
[M+Na]+ 287.10022 166.1
[M-H]- 263.10372 162.7
[M+NH4]+ 282.14482 175.7
[M+K]+ 303.07416 162.0
[M+H-H2O]+ 247.10826 152.7
[M+HCOO]- 309.10920 172.4
[M+CH3COO]- 323.12485 193.5
[M+Na-2H]- 285.08567 158.2
[M]+ 264.11045 152.4
[M]- 264.11155 152.4
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