CID 137949354

Tert-butyl 5-oxo-2,6-diazaspiro[3.5]nonane-2-carboxylate

Structural Information

Molecular Formula
C12H20N2O3
SMILES
CC(C)(C)OC(=O)N1CC2(C1)CCCNC2=O
InChI
InChI=1S/C12H20N2O3/c1-11(2,3)17-10(16)14-7-12(8-14)5-4-6-13-9(12)15/h4-8H2,1-3H3,(H,13,15)
InChIKey
KIPXSWOSXXIKHJ-UHFFFAOYSA-N
Compound name
tert-butyl 5-oxo-2,6-diazaspiro[3.5]nonane-2-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

240.1474 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 241.154676 157.3
[M+Na]+ 263.136618 161.3
[M-H]- 239.140124 158.1
[M+NH4]+ 258.181223 167.4
[M+K]+ 279.110558 162.8
[M+H-H2O]+ 223.144660 146.2
[M+HCOO]- 285.145601 169.1
[M+CH3COO]- 299.161251 190.3
[M+Na-2H]- 261.122066 160.7
[M]+ 240.14685142 162.0
[M]- 240.14794858 162.0
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.