CID 165605272

Tert-butyl 5,8-dioxo-2,6-diazaspiro[3.5]nonane-2-carboxylate

Structural Information

Molecular Formula
C12H18N2O4
SMILES
CC(C)(C)OC(=O)N1CC2(C1)CC(=O)CNC2=O
InChI
InChI=1S/C12H18N2O4/c1-11(2,3)18-10(17)14-6-12(7-14)4-8(15)5-13-9(12)16/h4-7H2,1-3H3,(H,13,16)
InChIKey
PTDKUTIEWBZSGF-UHFFFAOYSA-N
Compound name
tert-butyl 5,8-dioxo-2,6-diazaspiro[3.5]nonane-2-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

254.12666 Da
Monoisotopic Mass

-0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 255.13394 158.2
[M+Na]+ 277.11588 163.1
[M-H]- 253.11938 159.3
[M+NH4]+ 272.16048 167.8
[M+K]+ 293.08982 164.7
[M+H-H2O]+ 237.12392 147.4
[M+HCOO]- 299.12486 170.3
[M+CH3COO]- 313.14051 192.8
[M+Na-2H]- 275.10133 161.2
[M]+ 254.12611 164.0
[M]- 254.12721 164.0
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.