CID 53416068

1-tert-butylpiperidine-2,4-dione

Structural Information

Molecular Formula
C9H15NO2
SMILES
CC(C)(C)N1CCC(=O)CC1=O
InChI
InChI=1S/C9H15NO2/c1-9(2,3)10-5-4-7(11)6-8(10)12/h4-6H2,1-3H3
InChIKey
AULPPKYDOKRGAY-UHFFFAOYSA-N
Compound name
1-tert-butylpiperidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

23
Patents

169.11028 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 170.11756 137.7
[M+Na]+ 192.09950 148.3
[M+NH4]+ 187.14410 145.0
[M+K]+ 208.07344 143.5
[M-H]- 168.10300 137.7
[M+Na-2H]- 190.08495 141.6
[M]+ 169.10973 139.0
[M]- 169.11083 139.0
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