CID 21928275

1198787-34-6

Structural Information

Molecular Formula
C7H12N2O2
SMILES
CCC1(CCC(=O)NC1=O)N
InChI
InChI=1S/C7H12N2O2/c1-2-7(8)4-3-5(10)9-6(7)11/h2-4,8H2,1H3,(H,9,10,11)
InChIKey
JILPUMRNAYFAGK-UHFFFAOYSA-N
Compound name
3-amino-3-ethylpiperidine-2,6-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

82
Patents

156.08987 Da
Monoisotopic Mass

-1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 157.09715 132.3
[M+Na]+ 179.07909 139.5
[M-H]- 155.08259 132.7
[M+NH4]+ 174.12369 152.8
[M+K]+ 195.05303 137.4
[M+H-H2O]+ 139.08713 127.3
[M+HCOO]- 201.08807 151.5
[M+CH3COO]- 215.10372 174.8
[M+Na-2H]- 177.06454 137.2
[M]+ 156.08932 126.6
[M]- 156.09042 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

patents stripe