CID 212029

23804-90-2

Structural Information

Molecular Formula
C16H22N2O3
SMILES
COC(CN1CCC2(CC1)CNC(=O)O2)C3=CC=CC=C3
InChI
InChI=1S/C16H22N2O3/c1-20-14(13-5-3-2-4-6-13)11-18-9-7-16(8-10-18)12-17-15(19)21-16/h2-6,14H,7-12H2,1H3,(H,17,19)
InChIKey
CFFYJEOOYDTURT-UHFFFAOYSA-N
Compound name
8-(2-methoxy-2-phenylethyl)-1-oxa-3,8-diazaspiro[4.5]decan-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

290.16306 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 291.17034 168.9
[M+Na]+ 313.15228 172.7
[M-H]- 289.15578 173.0
[M+NH4]+ 308.19688 182.8
[M+K]+ 329.12622 170.4
[M+H-H2O]+ 273.16032 159.9
[M+HCOO]- 335.16126 182.2
[M+CH3COO]- 349.17691 178.0
[M+Na-2H]- 311.13773 170.5
[M]+ 290.16251 163.9
[M]- 290.16361 163.9
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.