CID 200021

Dimethylaminoethyl 7,8-dimethyl-2-oxo-1-oxa-3-azaspiro(4.5)decane-3-carboxylate fumarate

Structural Information

Molecular Formula
C15H26N2O4
SMILES
CC1CCC2(CC1C)CN(C(=O)O2)C(=O)OCCN(C)C
InChI
InChI=1S/C15H26N2O4/c1-11-5-6-15(9-12(11)2)10-17(14(19)21-15)13(18)20-8-7-16(3)4/h11-12H,5-10H2,1-4H3
InChIKey
AIKGEQWWIAKJGO-UHFFFAOYSA-N
Compound name
2-(dimethylamino)ethyl 7,8-dimethyl-2-oxo-1-oxa-3-azaspiro[4.5]decane-3-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

298.18927 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 299.19655 171.2
[M+Na]+ 321.17849 178.3
[M+NH4]+ 316.22309 178.3
[M+K]+ 337.15243 174.7
[M-H]- 297.18199 173.0
[M+Na-2H]- 319.16394 173.0
[M]+ 298.18872 172.4
[M]- 298.18982 172.4
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.