CID 163321462

2640660-85-9

Structural Information

Molecular Formula
C16H25NO3
SMILES
CC(C)(C)OC(=O)N1CCC2(CC1)CC3(C2)CC(=O)C3
InChI
InChI=1S/C16H25NO3/c1-14(2,3)20-13(19)17-6-4-15(5-7-17)10-16(11-15)8-12(18)9-16/h4-11H2,1-3H3
InChIKey
GYCCTASMDPZMSC-UHFFFAOYSA-N
Compound name
tert-butyl 2-oxo-9-azadispiro[3.1.56.14]dodecane-9-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

279.18344 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 280.19072 160.7
[M+Na]+ 302.17266 163.3
[M-H]- 278.17616 165.7
[M+NH4]+ 297.21726 166.7
[M+K]+ 318.14660 167.3
[M+H-H2O]+ 262.18070 147.4
[M+HCOO]- 324.18164 171.7
[M+CH3COO]- 338.19729 207.8
[M+Na-2H]- 300.15811 163.8
[M]+ 279.18289 174.2
[M]- 279.18399 174.2
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.