CID 212017

23804-72-0

Structural Information

Molecular Formula
C15H19ClN2O2
SMILES
C1CN(CCC12CNC(=O)O2)CCC3=CC=C(C=C3)Cl
InChI
InChI=1S/C15H19ClN2O2/c16-13-3-1-12(2-4-13)5-8-18-9-6-15(7-10-18)11-17-14(19)20-15/h1-4H,5-11H2,(H,17,19)
InChIKey
JZXOJASOYKVCNL-UHFFFAOYSA-N
Compound name
8-[2-(4-chlorophenyl)ethyl]-1-oxa-3,8-diazaspiro[4.5]decan-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

294.1135 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 295.120776 168.5
[M+Na]+ 317.102718 174.9
[M-H]- 293.106224 172.8
[M+NH4]+ 312.147323 183.6
[M+K]+ 333.076658 169.9
[M+H-H2O]+ 277.110760 160.1
[M+HCOO]- 339.111701 178.3
[M+CH3COO]- 353.127351 178.2
[M+Na-2H]- 315.088166 170.2
[M]+ 294.11295142 164.6
[M]- 294.11404858 164.6
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.