CID 132343719

Tert-butyl 4-azido-1-oxa-9-azaspiro[5.5]undecane-9-carboxylate

Structural Information

Molecular Formula
C14H24N4O3
SMILES
CC(C)(C)OC(=O)N1CCC2(CC1)CC(CCO2)N=[N+]=[N-]
InChI
InChI=1S/C14H24N4O3/c1-13(2,3)21-12(19)18-7-5-14(6-8-18)10-11(16-17-15)4-9-20-14/h11H,4-10H2,1-3H3
InChIKey
SGEYQPYWIULEEO-UHFFFAOYSA-N
Compound name
tert-butyl 4-azido-1-oxa-9-azaspiro[5.5]undecane-9-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

296.18484 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 297.19212 168.0
[M+Na]+ 319.17406 169.9
[M-H]- 295.17756 173.9
[M+NH4]+ 314.21866 182.5
[M+K]+ 335.14800 165.9
[M+H-H2O]+ 279.18210 164.6
[M+HCOO]- 341.18304 186.5
[M+CH3COO]- 355.19869 202.3
[M+Na-2H]- 317.15951 176.7
[M]+ 296.18429 161.2
[M]- 296.18539 161.2
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

No patent data available for this compound.