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]+ 293.149576 166.8
[M+Na]+ 315.131518 173.1
[M-H]- 291.135024 171.8
[M+NH4]+ 310.176123 181.3
[M+K]+ 331.105458 171.1
[M+H-H2O]+ 275.139560 158.4
[M+HCOO]- 337.140501 181.7
[M+CH3COO]- 351.156151 196.4
[M+Na-2H]- 313.116966 168.9
[M]+ 292.14175142 164.4
[M]- 292.14284858 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.