CID 71306068

Tert-butyl 5-oxo-2,6-diazaspiro[3.4]octane-2-carboxylate

Structural Information

Molecular Formula
C11H18N2O3
SMILES
CC(C)(C)OC(=O)N1CC2(C1)CCNC2=O
InChI
InChI=1S/C11H18N2O3/c1-10(2,3)16-9(15)13-6-11(7-13)4-5-12-8(11)14/h4-7H2,1-3H3,(H,12,14)
InChIKey
LGNYYNZLVBXFOT-UHFFFAOYSA-N
Compound name
tert-butyl 5-oxo-2,6-diazaspiro[3.4]octane-2-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

33
Patents

226.13174 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 227.139016 152.6
[M+Na]+ 249.120958 157.6
[M-H]- 225.124464 154.1
[M+NH4]+ 244.165563 165.1
[M+K]+ 265.094898 159.1
[M+H-H2O]+ 209.129000 142.5
[M+HCOO]- 271.129941 166.8
[M+CH3COO]- 285.145591 186.9
[M+Na-2H]- 247.106406 155.1
[M]+ 226.13119142 158.9
[M]- 226.13228858 158.9
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