CID 356425

3-(prop-2-en-1-yl)piperidine-2,6-dione

Structural Information

Molecular Formula
C8H11NO2
SMILES
C=CCC1CCC(=O)NC1=O
InChI
InChI=1S/C8H11NO2/c1-2-3-6-4-5-7(10)9-8(6)11/h2,6H,1,3-5H2,(H,9,10,11)
InChIKey
ZKWJADOQOFDEIW-UHFFFAOYSA-N
Compound name
3-prop-2-enylpiperidine-2,6-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

31
Patents

153.07898 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 154.08626 131.5
[M+Na]+ 176.06820 138.6
[M-H]- 152.07170 132.0
[M+NH4]+ 171.11280 150.7
[M+K]+ 192.04214 135.8
[M+H-H2O]+ 136.07624 125.9
[M+HCOO]- 198.07718 150.3
[M+CH3COO]- 212.09283 173.1
[M+Na-2H]- 174.05365 135.5
[M]+ 153.07843 127.0
[M]- 153.07953 127.0
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