CID 70347110

166306-17-8

Structural Information

Molecular Formula
C16H19NO3
SMILES
C1CC2(C1=O)CCN(CC2)C(=O)OCC3=CC=CC=C3
InChI
InChI=1S/C16H19NO3/c18-14-6-7-16(14)8-10-17(11-9-16)15(19)20-12-13-4-2-1-3-5-13/h1-5H,6-12H2
InChIKey
SVKFWHCFUVQMLM-UHFFFAOYSA-N
Compound name
benzyl 3-oxo-7-azaspiro[3.5]nonane-7-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

273.1365 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 274.14378 164.1
[M+Na]+ 296.12572 171.1
[M+NH4]+ 291.17032 169.1
[M+K]+ 312.09966 164.7
[M-H]- 272.12922 164.6
[M+Na-2H]- 294.11117 169.1
[M]+ 273.13595 164.0
[M]- 273.13705 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

patents stripe