CID 82665353

Tert-butyl 7-oxa-2,10-diazaspiro[4.6]undecane-10-carboxylate

Structural Information

Molecular Formula
C13H24N2O3
SMILES
CC(C)(C)OC(=O)N1CCOCC2(C1)CCNC2
InChI
InChI=1S/C13H24N2O3/c1-12(2,3)18-11(16)15-6-7-17-10-13(9-15)4-5-14-8-13/h14H,4-10H2,1-3H3
InChIKey
WJONJYOKAZQZDU-UHFFFAOYSA-N
Compound name
tert-butyl 7-oxa-2,10-diazaspiro[4.6]undecane-10-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

256.17868 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 257.185956 157.4
[M+Na]+ 279.167898 159.4
[M-H]- 255.171404 159.5
[M+NH4]+ 274.212503 172.1
[M+K]+ 295.141838 162.0
[M+H-H2O]+ 239.175940 149.8
[M+HCOO]- 301.176881 168.5
[M+CH3COO]- 315.192531 189.4
[M+Na-2H]- 277.153346 160.0
[M]+ 256.17813142 149.8
[M]- 256.17922858 149.8
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.