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]+ 295.12078 168.5
[M+Na]+ 317.10272 174.9
[M-H]- 293.10622 172.8
[M+NH4]+ 312.14732 183.6
[M+K]+ 333.07666 169.9
[M+H-H2O]+ 277.11076 160.1
[M+HCOO]- 339.11170 178.3
[M+CH3COO]- 353.12735 178.2
[M+Na-2H]- 315.08817 170.2
[M]+ 294.11295 164.6
[M]- 294.11405 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.