CID 137935997

2253630-36-1

Structural Information

Molecular Formula
C12H19NO4
SMILES
CC(C)(C)OC(=O)N1CC(=O)CC12CCOC2
InChI
InChI=1S/C12H19NO4/c1-11(2,3)17-10(15)13-7-9(14)6-12(13)4-5-16-8-12/h4-8H2,1-3H3
InChIKey
CZZKIJGSOVUQKH-UHFFFAOYSA-N
Compound name
tert-butyl 3-oxo-7-oxa-1-azaspiro[4.4]nonane-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

241.13141 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 242.13869 154.8
[M+Na]+ 264.12063 161.2
[M-H]- 240.12413 159.6
[M+NH4]+ 259.16523 175.6
[M+K]+ 280.09457 161.8
[M+H-H2O]+ 224.12867 150.6
[M+HCOO]- 286.12961 172.0
[M+CH3COO]- 300.14526 187.1
[M+Na-2H]- 262.10608 157.3
[M]+ 241.13086 154.6
[M]- 241.13196 154.6
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.