CID 71305780

1251021-18-7

Structural Information

Molecular Formula
C14H24N2O3
SMILES
CC(C)(C)OC(=O)N1CCC2(CCC(=O)NC2)CC1
InChI
InChI=1S/C14H24N2O3/c1-13(2,3)19-12(18)16-8-6-14(7-9-16)5-4-11(17)15-10-14/h4-10H2,1-3H3,(H,15,17)
InChIKey
RVORUJPDSDOBTI-UHFFFAOYSA-N
Compound name
tert-butyl 3-oxo-2,9-diazaspiro[5.5]undecane-9-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

268.17868 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 269.18596 166.2
[M+Na]+ 291.16790 169.6
[M-H]- 267.17140 166.3
[M+NH4]+ 286.21250 181.2
[M+K]+ 307.14184 167.5
[M+H-H2O]+ 251.17594 159.1
[M+HCOO]- 313.17688 176.1
[M+CH3COO]- 327.19253 191.8
[M+Na-2H]- 289.15335 168.7
[M]+ 268.17813 159.0
[M]- 268.17923 159.0
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

patents stripe