CID 83671095

Hexahydroindolizine-1,5-dione

Structural Information

Molecular Formula
C8H11NO2
SMILES
C1CC2C(=O)CCN2C(=O)C1
InChI
InChI=1S/C8H11NO2/c10-7-4-5-9-6(7)2-1-3-8(9)11/h6H,1-5H2
InChIKey
ZOBVPFYDIUBSGH-UHFFFAOYSA-N
Compound name
2,3,6,7,8,8a-hexahydroindolizine-1,5-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

153.07898 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 154.08626 130.6
[M+Na]+ 176.06820 138.0
[M-H]- 152.07170 133.3
[M+NH4]+ 171.11280 153.2
[M+K]+ 192.04214 136.3
[M+H-H2O]+ 136.07624 125.0
[M+HCOO]- 198.07718 149.8
[M+CH3COO]- 212.09283 174.4
[M+Na-2H]- 174.05365 134.6
[M]+ 153.07843 126.6
[M]- 153.07953 126.6
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.