CID 50853202

Tert-butyl 2-oxo-1,4,8-triazaspiro[4.5]decane-8-carboxylate

Structural Information

Molecular Formula
C12H21N3O3
SMILES
CC(C)(C)OC(=O)N1CCC2(CC1)NCC(=O)N2
InChI
InChI=1S/C12H21N3O3/c1-11(2,3)18-10(17)15-6-4-12(5-7-15)13-8-9(16)14-12/h13H,4-8H2,1-3H3,(H,14,16)
InChIKey
IOZYREZEVMLRIZ-UHFFFAOYSA-N
Compound name
tert-butyl 3-oxo-1,4,8-triazaspiro[4.5]decane-8-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

27
Patents

255.1583 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 256.16558 160.8
[M+Na]+ 278.14752 167.1
[M+NH4]+ 273.19212 166.8
[M+K]+ 294.12146 164.5
[M-H]- 254.15102 158.0
[M+Na-2H]- 276.13297 162.7
[M]+ 255.15775 160.4
[M]- 255.15885 160.4
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