CID 66545205

3-(3,4-dimethoxyphenyl)-1-oxa-3,8-diazaspiro[4.5]decan-2-one

Structural Information

Molecular Formula
C15H20N2O4
SMILES
COC1=C(C=C(C=C1)N2CC3(CCNCC3)OC2=O)OC
InChI
InChI=1S/C15H20N2O4/c1-19-12-4-3-11(9-13(12)20-2)17-10-15(21-14(17)18)5-7-16-8-6-15/h3-4,9,16H,5-8,10H2,1-2H3
InChIKey
IGUPZHNAAXMRJJ-UHFFFAOYSA-N
Compound name
3-(3,4-dimethoxyphenyl)-1-oxa-3,8-diazaspiro[4.5]decan-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

292.1423 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 293.14958 166.8
[M+Na]+ 315.13152 173.1
[M-H]- 291.13502 171.8
[M+NH4]+ 310.17612 181.3
[M+K]+ 331.10546 171.1
[M+H-H2O]+ 275.13956 158.4
[M+HCOO]- 337.14050 181.7
[M+CH3COO]- 351.15615 196.4
[M+Na-2H]- 313.11697 168.9
[M]+ 292.14175 164.4
[M]- 292.14285 164.4
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.