CID 212037

23804-95-7

Structural Information

Molecular Formula
C15H18N2O3
SMILES
C1CN(CCC12CNC(=O)O2)CC(=O)C3=CC=CC=C3
InChI
InChI=1S/C15H18N2O3/c18-13(12-4-2-1-3-5-12)10-17-8-6-15(7-9-17)11-16-14(19)20-15/h1-5H,6-11H2,(H,16,19)
InChIKey
PNXZXNSKOGHOAM-UHFFFAOYSA-N
Compound name
8-phenacyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

274.13174 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 275.13902 163.7
[M+Na]+ 297.12096 168.3
[M-H]- 273.12446 168.0
[M+NH4]+ 292.16556 178.2
[M+K]+ 313.09490 165.5
[M+H-H2O]+ 257.12900 155.0
[M+HCOO]- 319.12994 177.6
[M+CH3COO]- 333.14559 173.3
[M+Na-2H]- 295.10641 165.7
[M]+ 274.13119 157.6
[M]- 274.13229 157.6
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.