CID 199870

2-oxo-1-oxa-3-azaspiro(4.6)undecane-3-carboxylic acid dimethylaminoethyl ester hydrochloride

Structural Information

Molecular Formula
C14H24N2O4
SMILES
CN(C)CCOC(=O)N1CC2(CCCCCC2)OC1=O
InChI
InChI=1S/C14H24N2O4/c1-15(2)9-10-19-12(17)16-11-14(20-13(16)18)7-5-3-4-6-8-14/h3-11H2,1-2H3
InChIKey
OUTNOTQDSCDCSV-UHFFFAOYSA-N
Compound name
2-(dimethylamino)ethyl 2-oxo-1-oxa-3-azaspiro[4.6]undecane-3-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

284.1736 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 285.18088 162.4
[M+Na]+ 307.16282 164.2
[M-H]- 283.16632 168.4
[M+NH4]+ 302.20742 178.2
[M+K]+ 323.13676 168.5
[M+H-H2O]+ 267.17086 154.9
[M+HCOO]- 329.17180 179.1
[M+CH3COO]- 343.18745 202.5
[M+Na-2H]- 305.14827 163.5
[M]+ 284.17305 158.4
[M]- 284.17415 158.4
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.