CID 201494

Brn 0555111

Structural Information

Molecular Formula
C20H22N2O2
SMILES
C1CN(CCC12CNC(=O)O2)C(C3=CC=CC=C3)C4=CC=CC=C4
InChI
InChI=1S/C20H22N2O2/c23-19-21-15-20(24-19)11-13-22(14-12-20)18(16-7-3-1-4-8-16)17-9-5-2-6-10-17/h1-10,18H,11-15H2,(H,21,23)
InChIKey
VKWYTTLGBBLSSB-UHFFFAOYSA-N
Compound name
8-benzhydryl-1-oxa-3,8-diazaspiro[4.5]decan-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

322.16812 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 323.175396 177.8
[M+Na]+ 345.157338 181.3
[M-H]- 321.160844 184.8
[M+NH4]+ 340.201943 189.8
[M+K]+ 361.131278 176.8
[M+H-H2O]+ 305.165380 167.1
[M+HCOO]- 367.166321 190.8
[M+CH3COO]- 381.181971 186.2
[M+Na-2H]- 343.142786 178.9
[M]+ 322.16757142 169.9
[M]- 322.16866858 169.9
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.