CID 212027

23804-87-7

Structural Information

Molecular Formula
C22H26N2O2
SMILES
C1CN(CCC12CNC(=O)O2)CCC(C3=CC=CC=C3)C4=CC=CC=C4
InChI
InChI=1S/C22H26N2O2/c25-21-23-17-22(26-21)12-15-24(16-13-22)14-11-20(18-7-3-1-4-8-18)19-9-5-2-6-10-19/h1-10,20H,11-17H2,(H,23,25)
InChIKey
NQRHKALHURVSEA-UHFFFAOYSA-N
Compound name
8-(3,3-diphenylpropyl)-1-oxa-3,8-diazaspiro[4.5]decan-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

350.19943 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 351.20671 186.4
[M+Na]+ 373.18865 189.0
[M-H]- 349.19215 193.0
[M+NH4]+ 368.23325 197.2
[M+K]+ 389.16259 184.1
[M+H-H2O]+ 333.19669 175.3
[M+HCOO]- 395.19763 198.7
[M+CH3COO]- 409.21328 193.9
[M+Na-2H]- 371.17410 186.5
[M]+ 350.19888 179.2
[M]- 350.19998 179.2
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.