CID 12383651

65202-60-0

Structural Information

Molecular Formula
C12H19NO6
SMILES
CCOC(=O)C1CCN(CC12OCCO2)C(=O)OC
InChI
InChI=1S/C12H19NO6/c1-3-17-10(14)9-4-5-13(11(15)16-2)8-12(9)18-6-7-19-12/h9H,3-8H2,1-2H3
InChIKey
JCSIMGKOBJIXLB-UHFFFAOYSA-N
Compound name
6-O-ethyl 9-O-methyl 1,4-dioxa-9-azaspiro[4.5]decane-6,9-dicarboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

9
Patents

273.12125 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 274.12853 159.7
[M+Na]+ 296.11047 164.4
[M-H]- 272.11397 164.3
[M+NH4]+ 291.15507 175.5
[M+K]+ 312.08441 167.0
[M+H-H2O]+ 256.11851 153.8
[M+HCOO]- 318.11945 174.6
[M+CH3COO]- 332.13510 192.5
[M+Na-2H]- 294.09592 162.3
[M]+ 273.12070 160.7
[M]- 273.12180 160.7
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