CID 119056824

Tert-butyl 3-oxo-1,2,7-triazaspiro[4.4]nonane-7-carboxylate

Structural Information

Molecular Formula
C11H19N3O3
SMILES
CC(C)(C)OC(=O)N1CCC2(C1)CC(=O)NN2
InChI
InChI=1S/C11H19N3O3/c1-10(2,3)17-9(16)14-5-4-11(7-14)6-8(15)12-13-11/h13H,4-7H2,1-3H3,(H,12,15)
InChIKey
YTJOGGJXWKYVIA-UHFFFAOYSA-N
Compound name
tert-butyl 3-oxo-1,2,7-triazaspiro[4.4]nonane-7-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

241.14264 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 242.14992 156.2
[M+Na]+ 264.13186 161.6
[M+NH4]+ 259.17646 162.1
[M+K]+ 280.10580 161.5
[M-H]- 240.13536 152.8
[M+Na-2H]- 262.11731 157.6
[M]+ 241.14209 155.5
[M]- 241.14319 155.5
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.